Di- and tri­phenyl­acetate complexes of yttrium and europium

Ananyev, I.V.; Lyssenko, K.A.; Minyaev, M.E.; Nifant'ev, I.E.; Roitershtein, D.M.; Vinogradov, A.A.

doi:10.1107/S2053229616009748

Di- and triphenylacetate complexes of yttrium and europium

M. E. Minyaev, A. A. Vinogradov, D. M. Roitershtein, K. A. Lyssenko, I. V. Ananyev and I. E. Nifant'ev

The significant variety in the crystal structures of rare-earth carboxylate complexes is due to both the large coordination numbers of the rare-earth cations and the ability of the carboxylate anions to form several types of bridges between rare-earth metal atoms. Therefore, these complexes are represented by mono-, di- and polynuclear complexes, and by coordination polymers. The interaction of LnCl₃(thf)_x (Ln = Eu or Y; thf is tetrahydrofuran) with sodium or diethylammonium diphenylacetate in methanol followed by recrystallization from a DME/THF/hexane solvent mixture (DME is 1,2-dimethoxyethane) leads to crystals of the non-isomorphic dinuclear complexes tetrakis( [mu]

-2,2-diphenylacetato)- [kappa]

⁴O:O';

³O,O':O';

³O:O,O'-bis[(1,2-dimethoxyethane- [kappa]

²O,O')(2,2-diphenylacetato- [kappa]

²O,O')europium(III)], [Eu(C₁₄H₁₁O₂)₆(C₄H₁₀O₂)₂], (I), and tetrakis( [mu]

-2,2-diphenylacetato)- [kappa]

⁴O:O';

³O,O':O';

³O:O,O'-bis[(1,2-dimethoxyethane- [kappa]

²O,O')(2,2-diphenylacetato- [kappa]

²O,O')yttrium(III)], [Y(C₁₄H₁₁O₂)₆(C₄H₁₀O₂)₂], (II), possessing monoclinic (P2₁/c) symmetry. The [Ln(Ph₂CHCOO)₃(dme)]₂ molecule (Ln = Eu or Y) lies on an inversion centre and exhibits three different coordination modes of the diphenylacetate ligands, namely bidentate [kappa]

²O,O'-terminal, bidentate [mu]

₂-

¹O:

¹O'-bridging and tridentate [mu]

₂-

¹O:

²O,O'-semibridging. The terminal and bridging ligands in (I) are disordered over two positions, with an occupancy ratio of 0.806 (2):0.194 (2). The interaction of EuCl₃(thf)₂ with Na[Ph₃CCOO] in methanol followed by crystallization from hot methanol produces crystals of tetrakis(methanol- [kappa]

O)tris(2,2,2-triphenylacetato)- [kappa]

⁴O:O';

O-europium(III) methanol disolvate, [Eu(C₁₉H₁₅O₂)₃(CH₃OH)₄]·2CH₃OH, (III)·2MeOH, with triclinic (P $\overline{1}$ ) symmetry. The molecule of (III) contains two O,O'-bidentate and one O-monodentate terminal triphenylacetate ligand. (III)·2MeOH possesses one intramolecular and four intermolecular hydrogen bonds, forming a [(III)·2MeOH]₂ dimer with two bridging methanol molecules.

Keywords: diphenylacetate; triphenylacetate; yttrium; europium; rare-earth carboxylates; crystal structure; hydrogen bonding; molecular complex.

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Supporting information

	Crystallographic Information File (CIF) https://doi.org/10.1107/S2053229616009748/sk3627sup1.cif Contains datablocks mol-1, mol-2, mol-3, global
	Structure factor file (CIF format) https://doi.org/10.1107/S2053229616009748/sk3627mol-1sup2.hkl Contains datablock mol-1
	Chemdraw file https://doi.org/10.1107/S2053229616009748/sk3627mol-1sup5.cdx Supplementary material
	Structure factor file (CIF format) https://doi.org/10.1107/S2053229616009748/sk3627mol-2sup3.hkl Contains datablock mol-2
	Chemdraw file https://doi.org/10.1107/S2053229616009748/sk3627mol-2sup6.cdx Supplementary material
	Structure factor file (CIF format) https://doi.org/10.1107/S2053229616009748/sk3627mol-3sup4.hkl Contains datablock mol-3
	Chemdraw file https://doi.org/10.1107/S2053229616009748/sk3627mol-3sup7.cdx Supplementary material
	Portable Document Format (PDF) file https://doi.org/10.1107/S2053229616009748/sk3627sup8.pdf Ellipsoid plot for (I) showing the disorder

CCDC references: 1485773; 907206; 1485772

Computing details top

For all compounds, data collection: APEX2 (Bruker, 2008); cell refinement: SAINT (Bruker, 2008); data reduction: SAINT (Bruker, 2008); program(s) used to solve structure: SHELXS2013 (Sheldrick, 2008a); program(s) used to refine structure: SHELXL2014 (Sheldrick, 2015); molecular graphics: SHELXTL (Sheldrick, 2008a); software used to prepare material for publication: SHELXTL (Sheldrick, 2008a) and publCIF (Westrip, 2010).

(mol-1) Tetrakis(µ-2,2-diphenylacetato)-κ⁴O:O';κ³O,O':O';κ³O:O,O'-bis[(1,2-dimethoxyethane-κ²O,O')(2,2-diphenylacetato-κ²O,O')europium(III)] top

Crystal data top

[Eu(C₁₄H₁₁O₂)₆(C₄H₁₀O₂)₂]	F(000) = 1784
M_r = 1751.52	D_x = 1.502 Mg m⁻³
Monoclinic, P2₁/c	Mo Kα radiation, λ = 0.71073 Å
a = 12.0922 (6) Å	Cell parameters from 615 reflections
b = 13.9102 (7) Å	θ = 3–25°
c = 23.1235 (12) Å	µ = 1.68 mm⁻¹
β = 95.510 (1)°	T = 120 K
V = 3871.5 (3) Å³	Prism, colorless
Z = 2	0.32 × 0.24 × 0.21 mm

Data collection top

Bruker APEXII CCD area-detector diffractometer	8555 independent reflections
Radiation source: fine-focus sealed tube	6792 reflections with I > 2σ(I)
Graphite monochromator	R_int = 0.052
ω scans	θ_max = 27.1°, θ_min = 1.7°
Absorption correction: multi-scan (SADABS; Sheldrick, 1997)	h = −15→15
T_min = 0.602, T_max = 0.735	k = −17→17
41231 measured reflections	l = −29→29

Refinement top

Refinement on F²	Primary atom site location: structure-invariant direct methods
Least-squares matrix: full	Secondary atom site location: difference Fourier map
R[F² > 2σ(F²)] = 0.038	Hydrogen site location: inferred from neighbouring sites
wR(F²) = 0.091	H-atom parameters constrained
S = 1.02	w = 1/[σ²(F_o²) + (0.0464P)² + 3.2899P] where P = (F_o² + 2F_c²)/3
8555 reflections	(Δ/σ)_max = 0.002
508 parameters	Δρ_max = 2.47 e Å⁻³
10 restraints	Δρ_min = −1.60 e Å⁻³

Special details top

Geometry. All esds (except the esd in the dihedral angle between two l.s. planes) are estimated using the full covariance matrix. The cell esds are taken into account individually in the estimation of esds in distances, angles and torsion angles; correlations between esds in cell parameters are only used when they are defined by crystal symmetry. An approximate (isotropic) treatment of cell esds is used for estimating esds involving l.s. planes.

Fractional atomic coordinates and isotropic or equivalent isotropic displacement parameters (Å²) top

	x	y	z	U_iso*/U_eq	Occ. (<1)
Eu1	−0.07606 (2)	0.10805 (2)	0.53511 (2)	0.02187 (6)
O1	−0.2546 (3)	0.1672 (3)	0.49435 (18)	0.0451 (10)	0.806 (2)
O2	−0.1170 (2)	0.2603 (2)	0.47325 (12)	0.0358 (8)	0.806 (2)
C1	−0.2143 (4)	0.2441 (4)	0.4764 (3)	0.0228 (10)	0.806 (2)
C2	−0.3013 (4)	0.3247 (3)	0.46065 (19)	0.0258 (9)	0.806 (2)
H2	−0.3763	0.2953	0.4625	0.031*	0.806 (2)
C3	−0.2898 (3)	0.4053 (2)	0.50661 (14)	0.0291 (11)	0.806 (2)
C4	−0.3858 (2)	0.4347 (3)	0.53022 (17)	0.0484 (14)	0.806 (2)
H4	−0.4547	0.4045	0.5185	0.058*	0.806 (2)
C5	−0.3807 (3)	0.5083 (3)	0.57105 (19)	0.0584 (18)	0.806 (2)
H5	−0.4463	0.5284	0.5872	0.070*	0.806 (2)
C6	−0.2798 (4)	0.5525 (3)	0.58825 (18)	0.0527 (14)	0.806 (2)
H6	−0.2764	0.6028	0.6162	0.063*	0.806 (2)
C7	−0.1839 (3)	0.5231 (3)	0.56464 (18)	0.0507 (15)	0.806 (2)
H7	−0.1150	0.5533	0.5764	0.061*	0.806 (2)
C8	−0.1889 (2)	0.4495 (3)	0.52382 (16)	0.0408 (13)	0.806 (2)
H8	−0.1234	0.4294	0.5077	0.049*	0.806 (2)
C9	−0.2974 (3)	0.3629 (3)	0.39856 (11)	0.0253 (10)	0.806 (2)
C10	−0.3921 (3)	0.3577 (3)	0.35957 (17)	0.0346 (12)	0.806 (2)
H10	−0.4583	0.3300	0.3713	0.042*	0.806 (2)
C11	−0.3901 (3)	0.3929 (4)	0.30343 (14)	0.0437 (17)	0.806 (2)
H11	−0.4549	0.3893	0.2768	0.052*	0.806 (2)
C12	−0.2933 (3)	0.4333 (4)	0.28626 (11)	0.0403 (17)	0.806 (2)
H12	−0.2920	0.4574	0.2479	0.048*	0.806 (2)
C13	−0.1986 (3)	0.4385 (3)	0.32525 (15)	0.0362 (14)	0.806 (2)
H13	−0.1325	0.4662	0.3135	0.043*	0.806 (2)
C14	−0.2006 (3)	0.4033 (3)	0.38140 (13)	0.0290 (11)	0.806 (2)
H14	−0.1359	0.4069	0.4080	0.035*	0.806 (2)
O1'	−0.2078 (8)	0.2227 (15)	0.4814 (13)	0.0451 (10)	0.194 (2)
O2'	−0.0179 (7)	0.2569 (8)	0.4790 (6)	0.0358 (8)	0.194 (2)
C1'	−0.1170 (2)	0.2603 (2)	0.47325 (12)	0.0228 (10)	0.194 (2)
C2'	−0.1595 (13)	0.3663 (7)	0.4503 (5)	0.0258 (9)	0.194 (2)
H2'	−0.0894	0.3970	0.4398	0.031*	0.194 (2)
C3'	−0.2011 (13)	0.4393 (10)	0.4948 (6)	0.0291 (11)	0.194 (2)
C4'	−0.2991 (13)	0.4149 (12)	0.5181 (8)	0.0484 (14)	0.194 (2)
H4'	−0.3424	0.3624	0.5024	0.058*	0.194 (2)
C5'	−0.3338 (14)	0.4674 (14)	0.5642 (8)	0.0584 (18)	0.194 (2)
H5'	−0.4008	0.4507	0.5801	0.070*	0.194 (2)
C6'	−0.2704 (17)	0.5442 (13)	0.5871 (7)	0.0527 (14)	0.194 (2)
H6'	−0.2941	0.5801	0.6186	0.063*	0.194 (2)
C7'	−0.1724 (16)	0.5686 (11)	0.5638 (8)	0.0507 (15)	0.194 (2)
H7'	−0.1291	0.6212	0.5795	0.061*	0.194 (2)
C8'	−0.1377 (12)	0.5162 (11)	0.5177 (7)	0.0408 (13)	0.194 (2)
H8'	−0.0707	0.5328	0.5018	0.049*	0.194 (2)
C9'	−0.2398 (14)	0.3798 (12)	0.3934 (6)	0.0253 (10)	0.194 (2)
C10'	−0.3455 (16)	0.3395 (11)	0.3875 (7)	0.0346 (12)	0.194 (2)
H10'	−0.3723	0.3062	0.4193	0.042*	0.194 (2)
C11'	−0.4119 (11)	0.3478 (16)	0.3353 (9)	0.0437 (17)	0.194 (2)
H11'	−0.4842	0.3203	0.3313	0.052*	0.194 (2)
C12'	−0.3727 (18)	0.3964 (19)	0.2889 (6)	0.0403 (17)	0.194 (2)
H12'	−0.4182	0.4021	0.2532	0.048*	0.194 (2)
C13'	−0.267 (2)	0.4367 (17)	0.2947 (7)	0.0362 (14)	0.194 (2)
H13'	−0.2402	0.4699	0.2630	0.043*	0.194 (2)
C14'	−0.2006 (13)	0.4284 (13)	0.3469 (9)	0.0290 (11)	0.194 (2)
H14'	−0.1283	0.4559	0.3509	0.035*	0.194 (2)
O3	0.0023 (2)	0.04093 (18)	0.62973 (10)	0.0276 (6)
O4	0.0485 (3)	−0.03996 (19)	0.55479 (11)	0.0356 (7)
C15	0.0435 (3)	−0.0315 (3)	0.60920 (15)	0.0242 (8)
C16	0.0877 (3)	−0.1152 (2)	0.64734 (14)	0.0226 (7)
H16	0.1137	−0.1654	0.6208	0.027*
C17	0.1864 (3)	−0.0901 (2)	0.69071 (14)	0.0213 (7)
C18	0.2538 (3)	−0.1655 (3)	0.71199 (15)	0.0266 (8)
H18	0.2387	−0.2287	0.6977	0.032*
C19	0.3418 (3)	−0.1506 (3)	0.75320 (16)	0.0294 (8)
H19	0.3867	−0.2034	0.7671	0.035*
C20	0.3652 (3)	−0.0596 (3)	0.77454 (16)	0.0308 (9)
H20	0.4257	−0.0490	0.8032	0.037*
C21	0.2995 (4)	0.0154 (3)	0.7536 (2)	0.0429 (11)
H21	0.3148	0.0783	0.7682	0.051*
C22	0.2110 (4)	0.0012 (3)	0.71161 (18)	0.0350 (9)
H22	0.1673	0.0544	0.6972	0.042*
C23	−0.0039 (3)	−0.1607 (2)	0.67888 (14)	0.0222 (7)
C24	−0.0234 (3)	−0.2582 (3)	0.67293 (18)	0.0329 (9)
H24	0.0156	−0.2942	0.6465	0.039*
C25	−0.0985 (4)	−0.3045 (3)	0.7046 (2)	0.0403 (10)
H25	−0.1101	−0.3718	0.7002	0.048*
C26	−0.1565 (3)	−0.2531 (3)	0.74264 (19)	0.0354 (9)
H26	−0.2077	−0.2847	0.7649	0.043*
C27	−0.1399 (3)	−0.1553 (3)	0.74813 (16)	0.0281 (8)
H27	−0.1810	−0.1194	0.7737	0.034*
C28	−0.0640 (3)	−0.1089 (3)	0.71671 (15)	0.0266 (8)
H28	−0.0529	−0.0416	0.7210	0.032*
O5	0.0972 (3)	0.1517 (2)	0.51648 (14)	0.0254 (7)	0.806 (2)
O6	0.1850 (3)	0.0391 (2)	0.46825 (13)	0.0235 (7)	0.806 (2)
C29	0.1768 (4)	0.1217 (3)	0.49019 (18)	0.0211 (9)	0.806 (2)
C30	0.2697 (3)	0.1952 (3)	0.48521 (18)	0.0214 (9)	0.806 (2)
H30	0.2329	0.2528	0.4660	0.026*	0.806 (2)
C31	0.3152 (3)	0.2283 (2)	0.54571 (10)	0.0232 (10)	0.806 (2)
C32	0.3287 (3)	0.3259 (2)	0.55731 (14)	0.0308 (11)	0.806 (2)
H32	0.3117	0.3716	0.5273	0.037*	0.806 (2)
C33	0.3670 (3)	0.35647 (18)	0.61286 (18)	0.0359 (14)	0.806 (2)
H33	0.3762	0.4232	0.6208	0.043*	0.806 (2)
C34	0.3919 (3)	0.2895 (3)	0.65682 (11)	0.0388 (14)	0.806 (2)
H34	0.4181	0.3104	0.6948	0.047*	0.806 (2)
C35	0.3784 (3)	0.1920 (3)	0.64522 (14)	0.0354 (14)	0.806 (2)
H35	0.3953	0.1462	0.6753	0.043*	0.806 (2)
C36	0.3400 (3)	0.16134 (16)	0.58967 (17)	0.0312 (11)	0.806 (2)
H36	0.3308	0.0947	0.5817	0.037*	0.806 (2)
C37	0.3568 (3)	0.1631 (3)	0.44555 (16)	0.0236 (10)	0.806 (2)
C38	0.3292 (3)	0.1670 (4)	0.38584 (17)	0.0446 (19)	0.806 (2)
H38	0.2589	0.1914	0.3707	0.054*	0.806 (2)
C39	0.4045 (3)	0.1354 (4)	0.34822 (13)	0.0416 (17)	0.806 (2)
H39	0.3857	0.1381	0.3074	0.050*	0.806 (2)
C40	0.5074 (3)	0.0998 (3)	0.37032 (15)	0.0362 (12)	0.806 (2)
H40	0.5589	0.0782	0.3446	0.043*	0.806 (2)
C41	0.5350 (3)	0.0959 (3)	0.43003 (16)	0.0432 (14)	0.806 (2)
H41	0.6053	0.0715	0.4451	0.052*	0.806 (2)
C42	0.4597 (3)	0.1275 (3)	0.46764 (13)	0.0343 (14)	0.806 (2)
H42	0.4785	0.1248	0.5085	0.041*	0.806 (2)
O5'	0.1386 (11)	0.1205 (9)	0.5389 (6)	0.0254 (7)	0.194 (2)
O6'	0.2007 (11)	−0.0080 (8)	0.4957 (6)	0.0235 (7)	0.194 (2)
C29'	0.2138 (10)	0.0730 (9)	0.5186 (7)	0.0211 (9)	0.194 (2)
C30'	0.3334 (11)	0.1102 (13)	0.5266 (7)	0.0214 (9)	0.194 (2)
H30'	0.3810	0.0565	0.5436	0.026*	0.194 (2)
C31'	0.3499 (14)	0.1930 (11)	0.5671 (7)	0.0232 (10)	0.194 (2)
C32'	0.3418 (15)	0.2882 (14)	0.5487 (5)	0.0308 (11)	0.194 (2)
H32'	0.3255	0.3025	0.5086	0.037*	0.194 (2)
C33'	0.3575 (17)	0.3623 (8)	0.5890 (9)	0.0359 (14)	0.194 (2)
H33'	0.3519	0.4273	0.5764	0.043*	0.194 (2)
C34'	0.3813 (14)	0.3413 (12)	0.6476 (7)	0.0388 (14)	0.194 (2)
H34'	0.3920	0.3919	0.6751	0.047*	0.194 (2)
C35'	0.3895 (15)	0.2461 (15)	0.6660 (5)	0.0354 (14)	0.194 (2)
H35'	0.4057	0.2318	0.7061	0.043*	0.194 (2)
C36'	0.3738 (16)	0.1720 (9)	0.6257 (9)	0.0312 (11)	0.194 (2)
H36'	0.3793	0.1070	0.6382	0.037*	0.194 (2)
C37'	0.370 (2)	0.1308 (15)	0.4634 (10)	0.0236 (10)	0.194 (2)
C38'	0.299 (2)	0.1692 (19)	0.4244 (12)	0.0446 (19)	0.194 (2)
H38'	0.2288	0.1960	0.4302	0.054*	0.194 (2)
C39'	0.342 (3)	0.164 (3)	0.3786 (15)	0.0416 (17)	0.194 (2)
H39'	0.2866	0.1769	0.3474	0.050*	0.194 (2)
C40'	0.436 (3)	0.146 (2)	0.3576 (13)	0.0362 (12)	0.194 (2)
H40'	0.4497	0.1572	0.3184	0.043*	0.194 (2)
C41'	0.514 (2)	0.109 (2)	0.4007 (13)	0.0432 (14)	0.194 (2)
H41'	0.5867	0.0892	0.3936	0.052*	0.194 (2)
C42'	0.476 (3)	0.106 (2)	0.4516 (12)	0.0343 (14)	0.194 (2)
H42'	0.5250	0.0835	0.4833	0.041*	0.194 (2)
C43	−0.3225 (4)	0.0980 (4)	0.6067 (2)	0.0479 (12)
H43A	−0.3246	0.0377	0.5846	0.072*
H43B	−0.3730	0.1446	0.5863	0.072*
H43C	−0.3457	0.0858	0.6455	0.072*
O7	−0.2130 (2)	0.1351 (2)	0.61178 (14)	0.0501 (9)
C44	−0.1991 (5)	0.2145 (4)	0.6472 (2)	0.0557 (14)
H44A	−0.2164	0.1960	0.6867	0.067*
H44B	−0.2536	0.2640	0.6327	0.067*
C45	−0.0925 (4)	0.2556 (4)	0.6513 (2)	0.0575 (15)
H45A	−0.0981	0.3235	0.6635	0.069*
H45B	−0.0449	0.2216	0.6820	0.069*
O8	−0.0415 (3)	0.25250 (19)	0.59987 (11)	0.0366 (7)
C46	0.0516 (4)	0.3144 (3)	0.59644 (18)	0.0388 (10)
H46A	0.0724	0.3151	0.5565	0.058*
H46B	0.1143	0.2911	0.6227	0.058*
H46C	0.0321	0.3797	0.6077	0.058*

Atomic displacement parameters (Å²) top

	U¹¹	U²²	U³³	U¹²	U¹³	U²³
Eu1	0.02954 (11)	0.02123 (9)	0.01414 (9)	0.00756 (8)	−0.00151 (6)	−0.00247 (7)
O1	0.033 (2)	0.032 (2)	0.068 (3)	−0.0042 (16)	−0.0097 (18)	0.0178 (18)
O2	0.035 (2)	0.039 (2)	0.035 (2)	0.0023 (17)	0.0080 (15)	0.0006 (16)
C1	0.035 (3)	0.021 (3)	0.012 (2)	−0.008 (2)	0.0019 (18)	−0.0016 (19)
C2	0.024 (2)	0.028 (2)	0.026 (2)	0.0005 (19)	0.0032 (17)	−0.0007 (18)
C3	0.036 (3)	0.024 (2)	0.027 (3)	0.006 (2)	0.001 (2)	0.0045 (19)
C4	0.047 (3)	0.055 (4)	0.046 (3)	0.000 (3)	0.014 (3)	−0.009 (3)
C5	0.070 (5)	0.063 (4)	0.047 (4)	0.007 (4)	0.028 (3)	−0.015 (3)
C6	0.092 (4)	0.037 (3)	0.031 (2)	0.010 (3)	0.012 (3)	−0.009 (2)
C7	0.071 (4)	0.039 (4)	0.042 (3)	−0.002 (3)	0.002 (3)	−0.007 (3)
C8	0.045 (3)	0.034 (3)	0.044 (3)	0.003 (2)	0.006 (2)	−0.011 (3)
C9	0.026 (3)	0.023 (2)	0.026 (2)	0.010 (2)	−0.004 (2)	−0.0038 (17)
C10	0.033 (3)	0.027 (2)	0.043 (3)	0.007 (2)	−0.003 (2)	−0.011 (2)
C11	0.052 (3)	0.032 (3)	0.043 (4)	0.026 (3)	−0.017 (3)	−0.013 (3)
C12	0.071 (5)	0.027 (3)	0.020 (2)	0.014 (3)	−0.013 (3)	0.000 (2)
C13	0.063 (4)	0.021 (2)	0.023 (3)	0.008 (2)	−0.003 (2)	0.006 (2)
C14	0.039 (3)	0.023 (2)	0.024 (3)	0.007 (2)	−0.002 (2)	0.0066 (19)
O1'	0.033 (2)	0.032 (2)	0.068 (3)	−0.0042 (16)	−0.0097 (18)	0.0178 (18)
O2'	0.035 (2)	0.039 (2)	0.035 (2)	0.0023 (17)	0.0080 (15)	0.0006 (16)
C1'	0.035 (3)	0.021 (3)	0.012 (2)	−0.008 (2)	0.0019 (18)	−0.0016 (19)
C2'	0.024 (2)	0.028 (2)	0.026 (2)	0.0005 (19)	0.0032 (17)	−0.0007 (18)
C3'	0.036 (3)	0.024 (2)	0.027 (3)	0.006 (2)	0.001 (2)	0.0045 (19)
C4'	0.047 (3)	0.055 (4)	0.046 (3)	0.000 (3)	0.014 (3)	−0.009 (3)
C5'	0.070 (5)	0.063 (4)	0.047 (4)	0.007 (4)	0.028 (3)	−0.015 (3)
C6'	0.092 (4)	0.037 (3)	0.031 (2)	0.010 (3)	0.012 (3)	−0.009 (2)
C7'	0.071 (4)	0.039 (4)	0.042 (3)	−0.002 (3)	0.002 (3)	−0.007 (3)
C8'	0.045 (3)	0.034 (3)	0.044 (3)	0.003 (2)	0.006 (2)	−0.011 (3)
C9'	0.026 (3)	0.023 (2)	0.026 (2)	0.010 (2)	−0.004 (2)	−0.0038 (17)
C10'	0.033 (3)	0.027 (2)	0.043 (3)	0.007 (2)	−0.003 (2)	−0.011 (2)
C11'	0.052 (3)	0.032 (3)	0.043 (4)	0.026 (3)	−0.017 (3)	−0.013 (3)
C12'	0.071 (5)	0.027 (3)	0.020 (2)	0.014 (3)	−0.013 (3)	0.000 (2)
C13'	0.063 (4)	0.021 (2)	0.023 (3)	0.008 (2)	−0.003 (2)	0.006 (2)
C14'	0.039 (3)	0.023 (2)	0.024 (3)	0.007 (2)	−0.002 (2)	0.0066 (19)
O3	0.0422 (16)	0.0249 (13)	0.0155 (12)	0.0111 (12)	0.0019 (11)	0.0010 (10)
O4	0.0623 (19)	0.0292 (14)	0.0146 (13)	0.0179 (14)	−0.0004 (12)	0.0006 (10)
C15	0.033 (2)	0.0236 (18)	0.0161 (17)	0.0017 (15)	0.0006 (14)	0.0002 (14)
C16	0.0321 (19)	0.0200 (16)	0.0152 (16)	0.0063 (15)	−0.0001 (13)	−0.0004 (13)
C17	0.0248 (18)	0.0247 (18)	0.0152 (16)	0.0003 (14)	0.0053 (13)	0.0024 (13)
C18	0.032 (2)	0.0221 (18)	0.0254 (19)	−0.0010 (16)	−0.0002 (15)	0.0041 (15)
C19	0.026 (2)	0.032 (2)	0.030 (2)	0.0019 (16)	0.0021 (16)	0.0094 (16)
C20	0.028 (2)	0.038 (2)	0.025 (2)	−0.0030 (17)	−0.0031 (15)	−0.0019 (17)
C21	0.044 (3)	0.032 (2)	0.050 (3)	0.003 (2)	−0.007 (2)	−0.015 (2)
C22	0.039 (2)	0.0242 (19)	0.040 (2)	0.0081 (17)	−0.0070 (18)	−0.0041 (17)
C23	0.0259 (19)	0.0216 (18)	0.0178 (17)	0.0014 (14)	−0.0044 (13)	0.0001 (13)
C24	0.034 (2)	0.0242 (19)	0.041 (2)	0.0022 (17)	0.0063 (17)	−0.0054 (17)
C25	0.043 (3)	0.021 (2)	0.058 (3)	−0.0056 (18)	0.013 (2)	−0.0039 (19)
C26	0.030 (2)	0.034 (2)	0.043 (2)	−0.0047 (18)	0.0073 (18)	0.0068 (18)
C27	0.027 (2)	0.028 (2)	0.029 (2)	0.0006 (16)	0.0017 (15)	−0.0032 (15)
C28	0.033 (2)	0.0210 (17)	0.0254 (18)	−0.0009 (16)	−0.0015 (15)	−0.0030 (15)
O5	0.0248 (19)	0.0225 (17)	0.0296 (19)	0.0011 (13)	0.0060 (14)	−0.0078 (13)
O6	0.0262 (16)	0.0223 (16)	0.0226 (17)	−0.0023 (13)	0.0063 (13)	−0.0030 (12)
C29	0.024 (2)	0.021 (2)	0.017 (2)	−0.0009 (17)	−0.0015 (16)	0.0000 (15)
C30	0.021 (2)	0.023 (2)	0.020 (2)	−0.0002 (17)	0.0011 (16)	−0.0018 (16)
C31	0.019 (2)	0.025 (3)	0.026 (3)	−0.0029 (19)	0.0051 (18)	−0.0051 (19)
C32	0.029 (3)	0.026 (3)	0.037 (3)	−0.006 (2)	0.0020 (19)	−0.008 (2)
C33	0.034 (3)	0.033 (2)	0.040 (4)	−0.004 (2)	0.000 (3)	−0.018 (2)
C34	0.027 (3)	0.058 (4)	0.031 (3)	−0.006 (3)	0.001 (2)	−0.013 (3)
C35	0.030 (3)	0.050 (4)	0.025 (3)	0.000 (3)	−0.001 (2)	−0.004 (2)
C36	0.037 (3)	0.036 (3)	0.021 (3)	0.002 (2)	0.002 (2)	−0.001 (2)
C37	0.025 (2)	0.020 (3)	0.026 (3)	0.001 (2)	0.004 (2)	0.0024 (18)
C38	0.036 (4)	0.054 (4)	0.044 (4)	0.004 (3)	0.006 (3)	−0.017 (3)
C39	0.043 (4)	0.059 (4)	0.023 (3)	−0.002 (3)	0.003 (2)	0.001 (3)
C40	0.040 (3)	0.038 (3)	0.034 (3)	−0.001 (2)	0.018 (2)	0.001 (2)
C41	0.030 (3)	0.059 (4)	0.041 (4)	0.010 (3)	0.003 (3)	−0.001 (3)
C42	0.033 (3)	0.049 (4)	0.022 (3)	0.007 (2)	0.006 (2)	0.000 (2)
O5'	0.0248 (19)	0.0225 (17)	0.0296 (19)	0.0011 (13)	0.0060 (14)	−0.0078 (13)
O6'	0.0262 (16)	0.0223 (16)	0.0226 (17)	−0.0023 (13)	0.0063 (13)	−0.0030 (12)
C29'	0.024 (2)	0.021 (2)	0.017 (2)	−0.0009 (17)	−0.0015 (16)	0.0000 (15)
C30'	0.021 (2)	0.023 (2)	0.020 (2)	−0.0002 (17)	0.0011 (16)	−0.0018 (16)
C31'	0.019 (2)	0.025 (3)	0.026 (3)	−0.0029 (19)	0.0051 (18)	−0.0051 (19)
C32'	0.029 (3)	0.026 (3)	0.037 (3)	−0.006 (2)	0.0020 (19)	−0.008 (2)
C33'	0.034 (3)	0.033 (2)	0.040 (4)	−0.004 (2)	0.000 (3)	−0.018 (2)
C34'	0.027 (3)	0.058 (4)	0.031 (3)	−0.006 (3)	0.001 (2)	−0.013 (3)
C35'	0.030 (3)	0.050 (4)	0.025 (3)	0.000 (3)	−0.001 (2)	−0.004 (2)
C36'	0.037 (3)	0.036 (3)	0.021 (3)	0.002 (2)	0.002 (2)	−0.001 (2)
C37'	0.025 (2)	0.020 (3)	0.026 (3)	0.001 (2)	0.004 (2)	0.0024 (18)
C38'	0.036 (4)	0.054 (4)	0.044 (4)	0.004 (3)	0.006 (3)	−0.017 (3)
C39'	0.043 (4)	0.059 (4)	0.023 (3)	−0.002 (3)	0.003 (2)	0.001 (3)
C40'	0.040 (3)	0.038 (3)	0.034 (3)	−0.001 (2)	0.018 (2)	0.001 (2)
C41'	0.030 (3)	0.059 (4)	0.041 (4)	0.010 (3)	0.003 (3)	−0.001 (3)
C42'	0.033 (3)	0.049 (4)	0.022 (3)	0.007 (2)	0.006 (2)	0.000 (2)
C43	0.044 (3)	0.052 (3)	0.049 (3)	−0.007 (2)	0.016 (2)	−0.021 (2)
O7	0.0248 (16)	0.072 (2)	0.053 (2)	0.0056 (15)	0.0029 (13)	−0.0413 (17)
C44	0.085 (4)	0.048 (3)	0.039 (3)	−0.022 (3)	0.034 (3)	−0.022 (2)
C45	0.040 (3)	0.094 (4)	0.040 (3)	−0.005 (3)	0.011 (2)	−0.045 (3)
O8	0.0604 (19)	0.0252 (14)	0.0264 (15)	−0.0073 (13)	0.0163 (13)	−0.0082 (11)
C46	0.046 (3)	0.037 (2)	0.033 (2)	−0.004 (2)	0.0036 (18)	−0.0110 (18)

Geometric parameters (Å, º) top

Eu1—O1	2.416 (3)	C23—C24	1.382 (5)
Eu1—O1'	2.499 (10)	C23—C28	1.391 (5)
Eu1—O2	2.577 (3)	C24—C25	1.379 (6)
Eu1—O3	2.482 (2)	C24—H24	0.9500
Eu1—O4	2.566 (3)	C25—C26	1.377 (6)
Eu1—O4ⁱ	2.337 (3)	C25—H25	0.9500
Eu1—O5	2.262 (3)	C26—C27	1.379 (5)
Eu1—O6ⁱ	2.432 (3)	C26—H26	0.9500
Eu1—O6'ⁱ	2.124 (11)	C27—C28	1.384 (5)
Eu1—O7	2.567 (3)	C27—H27	0.9500
Eu1—O8	2.517 (3)	C28—H28	0.9500
Eu1—C1'	2.577 (3)	O5—C29	1.258 (5)
O1—C1	1.263 (6)	O6—C29	1.264 (5)
O2—C1	1.207 (6)	O6—Eu1ⁱ	2.432 (3)
C1—C2	1.557 (7)	C29—C30	1.531 (6)
C2—C9	1.536 (5)	C30—C31	1.525 (5)
C2—C3	1.542 (5)	C30—C37	1.528 (5)
C2—H2	1.0000	C30—H30	1.0000
C3—C4	1.3900	C31—C32	1.3900
C3—C8	1.3900	C31—C36	1.3900
C4—C5	1.3900	C32—C33	1.3900
C4—H4	0.9500	C32—H32	0.9500
C5—C6	1.3900	C33—C34	1.3900
C5—H5	0.9500	C33—H33	0.9500
C6—C7	1.3900	C34—C35	1.3900
C6—H6	0.9500	C34—H34	0.9500
C7—C8	1.3900	C35—C36	1.3900
C7—H7	0.9500	C35—H35	0.9500
C8—H8	0.9500	C36—H36	0.9500
C9—C10	1.3900	C37—C38	1.3900
C9—C14	1.3900	C37—C42	1.3900
C10—C11	1.3900	C38—C39	1.3900
C10—H10	0.9500	C38—H38	0.9500
C11—C12	1.3900	C39—C40	1.3900
C11—H11	0.9500	C39—H39	0.9500
C12—C13	1.3900	C40—C41	1.3900
C12—H12	0.9500	C40—H40	0.9500
C13—C14	1.3900	C41—C42	1.3900
C13—H13	0.9500	C41—H41	0.9500
C14—H14	0.9500	C42—H42	0.9500
O1'—C1'	1.247 (10)	O5'—C29'	1.251 (9)
O2'—C1'	1.193 (8)	O6'—C29'	1.248 (9)
C1'—C2'	1.633 (9)	O6'—Eu1ⁱ	2.124 (11)
C2'—C3'	1.563 (9)	C29'—C30'	1.531 (9)
C2'—C9'	1.571 (9)	C29'—Eu1ⁱ	3.203 (11)
C2'—H2'	1.0000	C30'—C31'	1.485 (19)
C3'—C4'	1.3900	C30'—C37'	1.59 (3)
C3'—C8'	1.3900	C30'—H30'	1.0000
C4'—C5'	1.3900	C31'—C32'	1.3900
C4'—H4'	0.9500	C31'—C36'	1.3900
C5'—C6'	1.3900	C32'—C33'	1.3900
C5'—H5'	0.9500	C32'—H32'	0.9500
C6'—C7'	1.3900	C33'—C34'	1.3900
C6'—H6'	0.9500	C33'—H33'	0.9500
C7'—C8'	1.3900	C34'—C35'	1.3900
C7'—H7'	0.9500	C34'—H34'	0.9500
C8'—H8'	0.9500	C35'—C36'	1.3900
C9'—C10'	1.3900	C35'—H35'	0.9500
C9'—C14'	1.3900	C36'—H36'	0.9500
C10'—C11'	1.3900	C37'—C38'	1.30 (3)
C10'—H10'	0.9500	C37'—C42'	1.38 (4)
C11'—C12'	1.3900	C38'—C39'	1.22 (4)
C11'—H11'	0.9500	C38'—H38'	0.9500
C12'—C13'	1.3900	C39'—C40'	1.30 (4)
C12'—H12'	0.9500	C39'—H39'	0.9500
C13'—C14'	1.3900	C40'—C41'	1.40 (4)
C13'—H13'	0.9500	C40'—H40'	0.9500
C14'—H14'	0.9500	C41'—C42'	1.31 (4)
O3—C15	1.239 (4)	C41'—H41'	0.9500
O4—C15	1.271 (4)	C42'—H42'	0.9500
O4—Eu1ⁱ	2.337 (3)	C43—O7	1.416 (5)
C15—C16	1.526 (5)	C43—H43A	0.9800
C16—C23	1.520 (5)	C43—H43B	0.9800
C16—C17	1.525 (5)	C43—H43C	0.9800
C16—H16	1.0000	O7—C44	1.375 (5)
C17—C22	1.381 (5)	C44—C45	1.404 (7)
C17—C18	1.389 (5)	C44—H44A	0.9900
C18—C19	1.374 (5)	C44—H44B	0.9900
C18—H18	0.9500	C45—O8	1.393 (5)
C19—C20	1.379 (6)	C45—H45A	0.9900
C19—H19	0.9500	C45—H45B	0.9900
C20—C21	1.371 (6)	O8—C46	1.426 (5)
C20—H20	0.9500	C46—H46A	0.9800
C21—C22	1.388 (6)	C46—H46B	0.9800
C21—H21	0.9500	C46—H46C	0.9800
C22—H22	0.9500

O6'ⁱ—Eu1—O4ⁱ	66.0 (3)	C17—C16—H16	106.9
O5—Eu1—O4ⁱ	74.08 (11)	C15—C16—H16	106.9
O5—Eu1—O1	130.07 (13)	C22—C17—C18	118.1 (3)
O4ⁱ—Eu1—O1	89.39 (12)	C22—C17—C16	124.8 (3)
O5—Eu1—O6ⁱ	136.79 (10)	C18—C17—C16	117.1 (3)
O4ⁱ—Eu1—O6ⁱ	75.73 (10)	C19—C18—C17	121.4 (3)
O1—Eu1—O6ⁱ	79.21 (11)	C19—C18—H18	119.3
O6'ⁱ—Eu1—O3	104.3 (4)	C17—C18—H18	119.3
O5—Eu1—O3	89.24 (11)	C18—C19—C20	120.3 (4)
O4ⁱ—Eu1—O3	123.83 (8)	C18—C19—H19	119.8
O1—Eu1—O3	136.33 (12)	C20—C19—H19	119.8
O6ⁱ—Eu1—O3	82.60 (10)	C21—C20—C19	118.7 (4)
O6'ⁱ—Eu1—O1'	81.6 (6)	C21—C20—H20	120.7
O4ⁱ—Eu1—O1'	87.4 (8)	C19—C20—H20	120.7
O3—Eu1—O1'	148.2 (7)	C20—C21—C22	121.4 (4)
O6'ⁱ—Eu1—O8	142.6 (3)	C20—C21—H21	119.3
O5—Eu1—O8	78.18 (10)	C22—C21—H21	119.3
O4ⁱ—Eu1—O8	145.39 (9)	C17—C22—C21	120.1 (4)
O1—Eu1—O8	92.95 (12)	C17—C22—H22	120.0
O6ⁱ—Eu1—O8	138.55 (9)	C21—C22—H22	120.0
O3—Eu1—O8	75.42 (9)	C24—C23—C28	118.4 (3)
O1'—Eu1—O8	81.2 (7)	C24—C23—C16	119.1 (3)
O6'ⁱ—Eu1—O4	85.4 (4)	C28—C23—C16	122.4 (3)
O5—Eu1—O4	73.17 (11)	C25—C24—C23	121.4 (4)
O4ⁱ—Eu1—O4	72.61 (9)	C25—C24—H24	119.3
O1—Eu1—O4	146.09 (11)	C23—C24—H24	119.3
O6ⁱ—Eu1—O4	68.73 (10)	C26—C25—C24	119.9 (4)
O3—Eu1—O4	51.23 (8)	C26—C25—H25	120.1
O1'—Eu1—O4	159.3 (8)	C24—C25—H25	120.1
O8—Eu1—O4	118.29 (9)	C25—C26—C27	119.5 (4)
O6'ⁱ—Eu1—O7	81.0 (3)	C25—C26—H26	120.2
O5—Eu1—O7	139.71 (10)	C27—C26—H26	120.2
O4ⁱ—Eu1—O7	146.11 (10)	C26—C27—C28	120.6 (4)
O1—Eu1—O7	66.92 (13)	C26—C27—H27	119.7
O6ⁱ—Eu1—O7	76.23 (10)	C28—C27—H27	119.7
O3—Eu1—O7	70.32 (10)	C27—C28—C23	120.1 (3)
O1'—Eu1—O7	80.0 (6)	C27—C28—H28	119.9
O8—Eu1—O7	63.47 (9)	C23—C28—H28	119.9
O4—Eu1—O7	113.69 (10)	C29—O5—Eu1	140.2 (3)
O6'ⁱ—Eu1—C1'	105.1 (4)	C29—O6—Eu1ⁱ	135.6 (3)
O4ⁱ—Eu1—C1'	82.86 (9)	O5—C29—O6	126.1 (4)
O3—Eu1—C1'	146.64 (9)	O5—C29—C30	114.5 (4)
O1'—Eu1—C1'	28.4 (2)	O6—C29—C30	119.3 (4)
O8—Eu1—C1'	71.70 (9)	C31—C30—C37	115.5 (3)
O4—Eu1—C1'	146.73 (9)	C31—C30—C29	109.6 (3)
O7—Eu1—C1'	99.25 (10)	C37—C30—C29	113.8 (3)
O5—Eu1—O2	78.79 (11)	C31—C30—H30	105.7
O4ⁱ—Eu1—O2	82.86 (9)	C37—C30—H30	105.7
O1—Eu1—O2	52.19 (11)	C29—C30—H30	105.7
O6ⁱ—Eu1—O2	126.85 (10)	C32—C31—C36	120.0
O3—Eu1—O2	146.64 (9)	C32—C31—C30	119.8 (3)
O8—Eu1—O2	71.70 (9)	C36—C31—C30	120.1 (3)
O4—Eu1—O2	146.73 (9)	C31—C32—C33	120.0
O7—Eu1—O2	99.25 (10)	C31—C32—H32	120.0
C1—O1—Eu1	93.3 (3)	C33—C32—H32	120.0
C1—O2—Eu1	87.1 (3)	C32—C33—C34	120.0
O2—C1—O1	126.0 (5)	C32—C33—H33	120.0
O2—C1—C2	119.5 (4)	C34—C33—H33	120.0
O1—C1—C2	114.4 (4)	C35—C34—C33	120.0
O2—C1—Eu1	67.3 (3)	C35—C34—H34	120.0
O1—C1—Eu1	59.8 (3)	C33—C34—H34	120.0
C2—C1—Eu1	164.2 (4)	C34—C35—C36	120.0
C9—C2—C3	112.6 (4)	C34—C35—H35	120.0
C9—C2—C1	112.8 (4)	C36—C35—H35	120.0
C3—C2—C1	110.4 (4)	C35—C36—C31	120.0
C9—C2—H2	106.9	C35—C36—H36	120.0
C3—C2—H2	106.9	C31—C36—H36	120.0
C1—C2—H2	106.9	C38—C37—C42	120.0
C4—C3—C8	120.0	C38—C37—C30	118.1 (3)
C4—C3—C2	117.5 (3)	C42—C37—C30	121.9 (3)
C8—C3—C2	122.5 (3)	C37—C38—C39	120.0
C5—C4—C3	120.0	C37—C38—H38	120.0
C5—C4—H4	120.0	C39—C38—H38	120.0
C3—C4—H4	120.0	C40—C39—C38	120.0
C4—C5—C6	120.0	C40—C39—H39	120.0
C4—C5—H5	120.0	C38—C39—H39	120.0
C6—C5—H5	120.0	C39—C40—C41	120.0
C7—C6—C5	120.0	C39—C40—H40	120.0
C7—C6—H6	120.0	C41—C40—H40	120.0
C5—C6—H6	120.0	C42—C41—C40	120.0
C6—C7—C8	120.0	C42—C41—H41	120.0
C6—C7—H7	120.0	C40—C41—H41	120.0
C8—C7—H7	120.0	C41—C42—C37	120.0
C7—C8—C3	120.0	C41—C42—H42	120.0
C7—C8—H8	120.0	C37—C42—H42	120.0
C3—C8—H8	120.0	C29'—O5'—Eu1	135.5 (10)
C10—C9—C14	120.0	C29'—O6'—Eu1ⁱ	142.3 (11)
C10—C9—C2	119.4 (3)	O6'—C29'—O5'	124.6 (13)
C14—C9—C2	120.6 (3)	O6'—C29'—C30'	115.9 (12)
C9—C10—C11	120.0	O5'—C29'—C30'	119.2 (12)
C9—C10—H10	120.0	C30'—C29'—Eu1ⁱ	139.8 (9)
C11—C10—H10	120.0	C31'—C30'—C29'	114.0 (13)
C10—C11—C12	120.0	C31'—C30'—C37'	113.9 (15)
C10—C11—H11	120.0	C29'—C30'—C37'	107.1 (14)
C12—C11—H11	120.0	C31'—C30'—H30'	107.1
C11—C12—C13	120.0	C29'—C30'—H30'	107.1
C11—C12—H12	120.0	C37'—C30'—H30'	107.1
C13—C12—H12	120.0	C32'—C31'—C36'	120.0
C14—C13—C12	120.0	C32'—C31'—C30'	123.0 (16)
C14—C13—H13	120.0	C36'—C31'—C30'	117.0 (16)
C12—C13—H13	120.0	C33'—C32'—C31'	120.0
C13—C14—C9	120.0	C33'—C32'—H32'	120.0
C13—C14—H14	120.0	C31'—C32'—H32'	120.0
C9—C14—H14	120.0	C32'—C33'—C34'	120.0
C1'—O1'—Eu1	79.3 (5)	C32'—C33'—H33'	120.0
C1'—O2'—Eu1	76.6 (4)	C34'—C33'—H33'	120.0
O2'—C1'—O1'	148.8 (7)	C33'—C34'—C35'	120.0
O2'—C1'—C2'	110.7 (8)	C33'—C34'—H34'	120.0
O1'—C1'—C2'	100.0 (9)	C35'—C34'—H34'	120.0
O2'—C1'—Eu1	76.6 (4)	C36'—C35'—C34'	120.0
O1'—C1'—Eu1	72.3 (5)	C36'—C35'—H35'	120.0
C2'—C1'—Eu1	163.7 (5)	C34'—C35'—H35'	120.0
C3'—C2'—C9'	105.2 (11)	C35'—C36'—C31'	120.0
C3'—C2'—C1'	119.0 (10)	C35'—C36'—H36'	120.0
C9'—C2'—C1'	122.0 (10)	C31'—C36'—H36'	120.0
C3'—C2'—H2'	102.5	C38'—C37'—C42'	122 (3)
C9'—C2'—H2'	102.5	C38'—C37'—C30'	119 (2)
C1'—C2'—H2'	102.5	C42'—C37'—C30'	119 (2)
C4'—C3'—C8'	120.0	C42'—C37'—C39'	86.6 (19)
C4'—C3'—C2'	115.9 (11)	C30'—C37'—C39'	153.9 (18)
C8'—C3'—C2'	123.4 (11)	C39'—C38'—C37'	106 (3)
C5'—C4'—C3'	120.0	C39'—C38'—H38'	127.1
C5'—C4'—H4'	120.0	C37'—C38'—H38'	127.1
C3'—C4'—H4'	120.0	C38'—C39'—C40'	142 (3)
C6'—C5'—C4'	120.0	C40'—C39'—C37'	104 (2)
C6'—C5'—H5'	120.0	C38'—C39'—H39'	108.9
C4'—C5'—H5'	120.0	C40'—C39'—H39'	108.9
C5'—C6'—C7'	120.0	C37'—C39'—H39'	145.7
C5'—C6'—H6'	120.0	C39'—C40'—C41'	111 (2)
C7'—C6'—H6'	120.0	C39'—C40'—H40'	124.5
C8'—C7'—C6'	120.0	C41'—C40'—H40'	124.5
C8'—C7'—H7'	120.0	C42'—C41'—C40'	112 (2)
C6'—C7'—H7'	120.0	C42'—C41'—H41'	123.8
C7'—C8'—C3'	120.0	C40'—C41'—H41'	123.8
C7'—C8'—H8'	120.0	C41'—C42'—C37'	126 (3)
C3'—C8'—H8'	120.0	C41'—C42'—H42'	117.1
C10'—C9'—C14'	120.0	C37'—C42'—H42'	117.1
C10'—C9'—C2'	121.4 (16)	O7—C43—H43A	109.5
C14'—C9'—C2'	118.4 (16)	O7—C43—H43B	109.5
C11'—C10'—C9'	120.0	H43A—C43—H43B	109.5
C11'—C10'—H10'	120.0	O7—C43—H43C	109.5
C9'—C10'—H10'	120.0	H43A—C43—H43C	109.5
C10'—C11'—C12'	120.0	H43B—C43—H43C	109.5
C10'—C11'—H11'	120.0	C44—O7—C43	113.8 (3)
C12'—C11'—H11'	120.0	C44—O7—Eu1	118.6 (3)
C13'—C12'—C11'	120.0	C43—O7—Eu1	123.3 (2)
C13'—C12'—H12'	120.0	O7—C44—C45	115.3 (4)
C11'—C12'—H12'	120.0	O7—C44—H44A	108.5
C12'—C13'—C14'	120.0	C45—C44—H44A	108.5
C12'—C13'—H13'	120.0	O7—C44—H44B	108.5
C14'—C13'—H13'	120.0	C45—C44—H44B	108.5
C13'—C14'—C9'	120.0	H44A—C44—H44B	107.5
C13'—C14'—H14'	120.0	O8—C45—C44	114.1 (4)
C9'—C14'—H14'	120.0	O8—C45—H45A	108.7
C15—O3—Eu1	95.8 (2)	C44—C45—H45A	108.7
C15—O4—Eu1ⁱ	160.5 (2)	O8—C45—H45B	108.7
C15—O4—Eu1	91.1 (2)	C44—C45—H45B	108.7
Eu1ⁱ—O4—Eu1	107.39 (9)	H45A—C45—H45B	107.6
O3—C15—O4	120.9 (3)	C45—O8—C46	116.5 (3)
O3—C15—C16	122.0 (3)	C45—O8—Eu1	118.1 (3)
O4—C15—C16	117.0 (3)	C46—O8—Eu1	122.4 (2)
O3—C15—Eu1	58.86 (18)	O8—C46—H46A	109.5
O4—C15—Eu1	62.80 (18)	O8—C46—H46B	109.5
C16—C15—Eu1	169.9 (3)	H46A—C46—H46B	109.5
C23—C16—C17	109.9 (3)	O8—C46—H46C	109.5
C23—C16—C15	111.4 (3)	H46A—C46—H46C	109.5
C17—C16—C15	114.4 (3)	H46B—C46—H46C	109.5
C23—C16—H16	106.9

Eu1—O2—C1—O1	−12.3 (6)	C16—C17—C22—C21	176.3 (4)
Eu1—O2—C1—C2	164.1 (5)	C20—C21—C22—C17	1.1 (7)
Eu1—O1—C1—O2	13.1 (7)	C17—C16—C23—C24	−107.1 (4)
Eu1—O1—C1—C2	−163.5 (4)	C15—C16—C23—C24	125.1 (4)
O2—C1—C2—C9	57.7 (7)	C17—C16—C23—C28	68.5 (4)
O1—C1—C2—C9	−125.5 (5)	C15—C16—C23—C28	−59.3 (4)
Eu1—C1—C2—C9	169.6 (11)	C28—C23—C24—C25	−1.7 (6)
O2—C1—C2—C3	−69.2 (6)	C16—C23—C24—C25	174.1 (4)
O1—C1—C2—C3	107.6 (5)	C23—C24—C25—C26	0.7 (7)
Eu1—C1—C2—C3	42.7 (14)	C24—C25—C26—C27	0.8 (7)
C9—C2—C3—C4	103.4 (4)	C25—C26—C27—C28	−1.3 (6)
C1—C2—C3—C4	−129.6 (3)	C26—C27—C28—C23	0.3 (6)
C9—C2—C3—C8	−75.4 (4)	C24—C23—C28—C27	1.1 (5)
C1—C2—C3—C8	51.6 (5)	C16—C23—C28—C27	−174.5 (3)
C8—C3—C4—C5	0.0	Eu1—O5—C29—O6	−9.3 (8)
C2—C3—C4—C5	−178.8 (4)	Eu1—O5—C29—C30	170.3 (3)
C3—C4—C5—C6	0.0	Eu1ⁱ—O6—C29—O5	−4.0 (7)
C4—C5—C6—C7	0.0	Eu1ⁱ—O6—C29—C30	176.5 (3)
C5—C6—C7—C8	0.0	O5—C29—C30—C31	57.7 (5)
C6—C7—C8—C3	0.0	O6—C29—C30—C31	−122.7 (4)
C4—C3—C8—C7	0.0	O5—C29—C30—C37	−171.3 (4)
C2—C3—C8—C7	178.7 (4)	O6—C29—C30—C37	8.3 (6)
C3—C2—C9—C10	−112.7 (3)	C37—C30—C31—C32	98.2 (4)
C1—C2—C9—C10	121.6 (4)	C29—C30—C31—C32	−131.7 (3)
C3—C2—C9—C14	66.6 (4)	C37—C30—C31—C36	−83.7 (4)
C1—C2—C9—C14	−59.1 (5)	C29—C30—C31—C36	46.4 (4)
C14—C9—C10—C11	0.0	C36—C31—C32—C33	0.0
C2—C9—C10—C11	179.3 (3)	C30—C31—C32—C33	178.1 (3)
C9—C10—C11—C12	0.0	C31—C32—C33—C34	0.0
C10—C11—C12—C13	0.0	C32—C33—C34—C35	0.0
C11—C12—C13—C14	0.0	C33—C34—C35—C36	0.0
C12—C13—C14—C9	0.0	C34—C35—C36—C31	0.0
C10—C9—C14—C13	0.0	C32—C31—C36—C35	0.0
C2—C9—C14—C13	−179.3 (4)	C30—C31—C36—C35	−178.1 (3)
Eu1—O2'—C1'—O1'	−5 (3)	C31—C30—C37—C38	−156.1 (3)
Eu1—O2'—C1'—C2'	164.8 (5)	C29—C30—C37—C38	75.9 (4)
Eu1—O1'—C1'—O2'	5 (3)	C31—C30—C37—C42	26.2 (5)
Eu1—O1'—C1'—C2'	−165.2 (5)	C29—C30—C37—C42	−101.8 (4)
O2'—C1'—C2'—C3'	−101.6 (14)	C42—C37—C38—C39	0.0
O1'—C1'—C2'—C3'	73 (2)	C30—C37—C38—C39	−177.8 (4)
Eu1—C1'—C2'—C3'	13 (3)	C37—C38—C39—C40	0.0
O2'—C1'—C2'—C9'	124.0 (15)	C38—C39—C40—C41	0.0
O1'—C1'—C2'—C9'	−62 (2)	C39—C40—C41—C42	0.0
Eu1—C1'—C2'—C9'	−121.7 (16)	C40—C41—C42—C37	0.0
C9'—C2'—C3'—C4'	73.8 (14)	C38—C37—C42—C41	0.0
C1'—C2'—C3'—C4'	−67.3 (14)	C30—C37—C42—C41	177.7 (4)
C9'—C2'—C3'—C8'	−116.3 (15)	Eu1ⁱ—O6'—C29'—O5'	10 (3)
C1'—C2'—C3'—C8'	102.6 (15)	Eu1ⁱ—O6'—C29'—C30'	−175.5 (13)
C8'—C3'—C4'—C5'	0.0	Eu1—O5'—C29'—O6'	−11 (3)
C2'—C3'—C4'—C5'	170.3 (14)	Eu1—O5'—C29'—C30'	174.5 (12)
C3'—C4'—C5'—C6'	0.0	Eu1—O5'—C29'—Eu1ⁱ	−7.2 (19)
C4'—C5'—C6'—C7'	0.0	O6'—C29'—C30'—C31'	−164.9 (17)
C5'—C6'—C7'—C8'	0.0	O5'—C29'—C30'—C31'	10 (2)
C6'—C7'—C8'—C3'	0.0	Eu1ⁱ—C29'—C30'—C31'	−167.7 (14)
C4'—C3'—C8'—C7'	0.0	O6'—C29'—C30'—C37'	68 (2)
C2'—C3'—C8'—C7'	−169.6 (15)	O5'—C29'—C30'—C37'	−117.2 (19)
C3'—C2'—C9'—C10'	−78.6 (14)	Eu1ⁱ—C29'—C30'—C37'	65 (2)
C1'—C2'—C9'—C10'	61.0 (17)	C29'—C30'—C31'—C32'	−91.9 (17)
C3'—C2'—C9'—C14'	105.2 (14)	C37'—C30'—C31'—C32'	31 (2)
C1'—C2'—C9'—C14'	−115.2 (14)	C29'—C30'—C31'—C36'	87.6 (16)
C14'—C9'—C10'—C11'	0.0	C37'—C30'—C31'—C36'	−149.0 (14)
C2'—C9'—C10'—C11'	−176.1 (15)	C36'—C31'—C32'—C33'	0.0
C9'—C10'—C11'—C12'	0.0	C30'—C31'—C32'—C33'	179.6 (15)
C10'—C11'—C12'—C13'	0.0	C31'—C32'—C33'—C34'	0.0
C11'—C12'—C13'—C14'	0.0	C32'—C33'—C34'—C35'	0.0
C12'—C13'—C14'—C9'	0.0	C33'—C34'—C35'—C36'	0.0
C10'—C9'—C14'—C13'	0.0	C34'—C35'—C36'—C31'	0.0
C2'—C9'—C14'—C13'	176.3 (14)	C32'—C31'—C36'—C35'	0.0
Eu1—O3—C15—O4	10.2 (4)	C30'—C31'—C36'—C35'	−179.6 (14)
Eu1—O3—C15—C16	−168.2 (3)	C31'—C30'—C37'—C38'	−87 (2)
Eu1ⁱ—O4—C15—O3	−170.9 (6)	C29'—C30'—C37'—C38'	40 (3)
Eu1—O4—C15—O3	−9.8 (4)	C31'—C30'—C37'—C42'	94 (2)
Eu1ⁱ—O4—C15—C16	7.6 (10)	C29'—C30'—C37'—C42'	−139 (2)
Eu1—O4—C15—C16	168.7 (3)	C31'—C30'—C37'—C39'	−100 (4)
Eu1ⁱ—O4—C15—Eu1	−161.1 (9)	C29'—C30'—C37'—C39'	27 (5)
O3—C15—C16—C23	61.4 (5)	C42'—C37'—C38'—C39'	9 (4)
O4—C15—C16—C23	−117.0 (4)	C30'—C37'—C38'—C39'	−170 (3)
Eu1—C15—C16—C23	−30.6 (15)	C37'—C38'—C39'—C40'	−13 (7)
O3—C15—C16—C17	−63.9 (5)	C38'—C39'—C40'—C41'	11 (7)
O4—C15—C16—C17	117.6 (4)	C37'—C39'—C40'—C41'	2 (3)
Eu1—C15—C16—C17	−156.0 (12)	C39'—C40'—C41'—C42'	−3 (4)
C23—C16—C17—C22	−102.1 (4)	C40'—C41'—C42'—C37'	2 (5)
C15—C16—C17—C22	24.0 (5)	C38'—C37'—C42'—C41'	−6 (5)
C23—C16—C17—C18	75.5 (4)	C30'—C37'—C42'—C41'	173 (3)
C15—C16—C17—C18	−158.4 (3)	C39'—C37'—C42'—C41'	−1 (3)
C22—C17—C18—C19	0.8 (6)	C43—O7—C44—C45	−177.4 (5)
C16—C17—C18—C19	−177.0 (3)	Eu1—O7—C44—C45	−20.1 (6)
C17—C18—C19—C20	0.0 (6)	O7—C44—C45—O8	35.9 (8)
C18—C19—C20—C21	−0.3 (6)	C44—C45—O8—C46	163.7 (5)
C19—C20—C21—C22	−0.2 (7)	C44—C45—O8—Eu1	−35.3 (6)
C18—C17—C22—C21	−1.3 (6)

Symmetry code: (i) −x, −y, −z+1.

Hydrogen-bond geometry (Å, º) top

D—H···A	D—H	H···A	D···A	D—H···A
C16—H16···O2ⁱ	1.00	2.55	3.488 (4)	157
C43—H43A···O6ⁱ	0.98	2.43	3.155 (5)	131
C43—H43A···O6′ⁱ	0.98	2.53	3.164 (12)	122
C46—H46A···O2′	0.98	2.16	2.878 (14)	129
C46—H46A···O5	0.98	2.48	3.007 (5)	113

Symmetry code: (i) −x, −y, −z+1.

(mol-2) Tetrakis(µ-2,2-diphenylacetato)-κ⁴O:O';κ³O,O':O';κ³O:O,O'-bis[(1,2-dimethoxyethane-κ²O,O')(2,2-diphenylacetato-κ²O,O')yttrium(III)] top

Crystal data top

[Y(C₁₄H₁₁O₂)₆(C₄H₁₀O₂)₂]	F(000) = 1688
M_r = 1625.42	D_x = 1.385 Mg m⁻³
Monoclinic, P2₁/c	Mo Kα radiation, λ = 0.71073 Å
a = 11.4292 (17) Å	Cell parameters from 1280 reflections
b = 21.371 (3) Å	θ = 2.6–29.7°
c = 16.335 (3) Å	µ = 1.55 mm⁻¹
β = 102.370 (5)°	T = 100 K
V = 3897.3 (10) Å³	Prism, colorless
Z = 2	0.24 × 0.19 × 0.16 mm

Data collection top

Bruker APEXII CCD area-detector diffractometer	12128 independent reflections
Radiation source: fine-focus sealed tube	8929 reflections with I > 2σ(I)
Graphite monochromator	R_int = 0.043
ω scans	θ_max = 30.8°, θ_min = 1.6°
Absorption correction: multi-scan (SADABS; Sheldrick, 1997)	h = −16→16
T_min = 0.705, T_max = 0.790	k = −30→24
33597 measured reflections	l = −19→23

Refinement top

Refinement on F²	Primary atom site location: structure-invariant direct methods
Least-squares matrix: full	Secondary atom site location: difference Fourier map
R[F² > 2σ(F²)] = 0.041	Hydrogen site location: inferred from neighbouring sites
wR(F²) = 0.094	H-atom parameters constrained
S = 1.01	w = 1/[σ²(F_o²) + (0.0445P)² + 1.2617P] where P = (F_o² + 2F_c²)/3
12128 reflections	(Δ/σ)_max = 0.002
498 parameters	Δρ_max = 0.92 e Å⁻³
0 restraints	Δρ_min = −0.51 e Å⁻³

Special details top

Refinement. Refinement of F² against ALL reflections. The weighted R-factor wR and goodness of fit S are based on F², conventional R-factors R are based on F, with F set to zero for negative F². The threshold expression of F² > 2sigma(F²) is used only for calculating R-factors(gt) etc. and is not relevant to the choice of reflections for refinement. R-factors based on F² are statistically about twice as large as those based on F, and R- factors based on ALL data will be even larger.

Fractional atomic coordinates and isotropic or equivalent isotropic displacement parameters (Å²) top

	x	y	z	U_iso*/U_eq
Y1	0.06134 (2)	0.41723 (2)	−0.01806 (2)	0.01006 (5)
O1	0.26086 (11)	0.38140 (7)	0.02658 (8)	0.0179 (3)
O2	0.14496 (11)	0.35956 (6)	0.11361 (8)	0.0150 (3)
C1	0.24248 (16)	0.35328 (9)	0.09064 (11)	0.0133 (4)
C2	0.34124 (16)	0.30967 (9)	0.13653 (12)	0.0143 (4)
H2	0.4128	0.3174	0.1118	0.017*
C3	0.38120 (16)	0.32184 (9)	0.23036 (12)	0.0145 (4)
C4	0.30109 (17)	0.32045 (9)	0.28360 (12)	0.0177 (4)
H4	0.2180	0.3147	0.2611	0.021*
C5	0.34236 (19)	0.32744 (10)	0.36986 (13)	0.0214 (4)
H5	0.2871	0.3264	0.4058	0.026*
C6	0.4632 (2)	0.33583 (10)	0.40354 (13)	0.0241 (5)
H6	0.4909	0.3401	0.4624	0.029*
C7	0.54361 (18)	0.33790 (10)	0.35092 (14)	0.0245 (5)
H7	0.6265	0.3441	0.3736	0.029*
C8	0.50275 (17)	0.33090 (10)	0.26505 (13)	0.0204 (4)
H8	0.5583	0.3323	0.2293	0.024*
C9	0.30824 (18)	0.24087 (9)	0.12036 (12)	0.0169 (4)
C10	0.19123 (19)	0.21930 (10)	0.09452 (13)	0.0233 (4)
H10	0.1265	0.2481	0.0870	0.028*
C11	0.1683 (2)	0.15614 (11)	0.07968 (15)	0.0298 (5)
H11	0.0881	0.1421	0.0614	0.036*
C12	0.2615 (2)	0.11349 (11)	0.09131 (14)	0.0310 (5)
H12	0.2454	0.0703	0.0804	0.037*
C13	0.3776 (2)	0.13381 (11)	0.11872 (15)	0.0308 (5)
H13	0.4417	0.1046	0.1277	0.037*
C14	0.4007 (2)	0.19704 (10)	0.13317 (14)	0.0246 (5)
H14	0.4810	0.2107	0.1521	0.029*
O3	−0.10951 (11)	0.40930 (6)	−0.13350 (8)	0.0161 (3)
O4	−0.09691 (11)	0.50198 (6)	−0.07586 (8)	0.0131 (3)
C15	−0.15262 (16)	0.46262 (9)	−0.12852 (11)	0.0130 (3)
C16	−0.27238 (16)	0.48187 (9)	−0.18324 (11)	0.0131 (3)
H16	−0.2845	0.5271	−0.1718	0.016*
C17	−0.28098 (15)	0.47532 (9)	−0.27712 (11)	0.0131 (4)
C18	−0.36386 (16)	0.51349 (9)	−0.32980 (12)	0.0167 (4)
H18	−0.4096	0.5428	−0.3061	0.020*
C19	−0.38023 (18)	0.50920 (10)	−0.41591 (13)	0.0198 (4)
H19	−0.4363	0.5358	−0.4508	0.024*
C20	−0.31514 (17)	0.46624 (10)	−0.45152 (12)	0.0195 (4)
H20	−0.3278	0.4625	−0.5107	0.023*
C21	−0.23140 (18)	0.42885 (10)	−0.39998 (13)	0.0199 (4)
H21	−0.1849	0.4001	−0.4240	0.024*
C22	−0.21489 (17)	0.43307 (9)	−0.31303 (12)	0.0164 (4)
H22	−0.1580	0.4068	−0.2782	0.020*
C23	−0.37353 (16)	0.44558 (10)	−0.15690 (11)	0.0157 (4)
C24	−0.39255 (18)	0.38265 (10)	−0.17601 (12)	0.0192 (4)
H24	−0.3401	0.3611	−0.2043	0.023*
C25	−0.48753 (19)	0.35078 (11)	−0.15429 (13)	0.0252 (5)
H25	−0.5004	0.3078	−0.1680	0.030*
C26	−0.56320 (18)	0.38218 (12)	−0.11247 (13)	0.0281 (5)
H26	−0.6281	0.3606	−0.0974	0.034*
C27	−0.54500 (19)	0.44430 (12)	−0.09273 (14)	0.0296 (5)
H27	−0.5971	0.4654	−0.0638	0.036*
C28	−0.45065 (18)	0.47644 (11)	−0.11480 (13)	0.0226 (4)
H28	−0.4387	0.5195	−0.1012	0.027*
O5	0.14799 (11)	0.49272 (6)	−0.08497 (8)	0.0146 (3)
O6	0.09256 (11)	0.58846 (6)	−0.05218 (8)	0.0130 (3)
C29	0.14548 (15)	0.55147 (9)	−0.09148 (11)	0.0115 (3)
C30	0.20996 (15)	0.57903 (9)	−0.15688 (11)	0.0126 (3)
H30	0.2849	0.5542	−0.1541	0.015*
C31	0.13202 (16)	0.56988 (8)	−0.24406 (11)	0.0139 (4)
C32	0.00793 (17)	0.57828 (9)	−0.25961 (12)	0.0168 (4)
H32	−0.0294	0.5887	−0.2148	0.020*
C33	−0.06123 (18)	0.57149 (9)	−0.34029 (13)	0.0200 (4)
H33	−0.1456	0.5771	−0.3504	0.024*
C34	−0.0071 (2)	0.55654 (10)	−0.40584 (13)	0.0229 (4)
H34	−0.0542	0.5518	−0.4609	0.027*
C35	0.1152 (2)	0.54858 (11)	−0.39113 (13)	0.0257 (5)
H35	0.1523	0.5387	−0.4363	0.031*
C36	0.18489 (18)	0.55499 (10)	−0.31046 (12)	0.0202 (4)
H36	0.2691	0.5491	−0.3009	0.024*
C37	0.24667 (16)	0.64662 (9)	−0.13746 (12)	0.0144 (4)
C38	0.19387 (18)	0.69640 (10)	−0.18591 (13)	0.0221 (4)
H38	0.1334	0.6888	−0.2347	0.027*
C39	0.2290 (2)	0.75759 (10)	−0.16349 (15)	0.0282 (5)
H39	0.1919	0.7915	−0.1967	0.034*
C40	0.31766 (19)	0.76911 (10)	−0.09318 (14)	0.0246 (5)
H40	0.3410	0.8109	−0.0779	0.030*
C41	0.37235 (18)	0.71975 (10)	−0.04513 (13)	0.0228 (4)
H41	0.4339	0.7275	0.0030	0.027*
C42	0.33722 (17)	0.65890 (10)	−0.06721 (12)	0.0181 (4)
H42	0.3753	0.6251	−0.0341	0.022*
O7	0.00552 (12)	0.30376 (6)	−0.04379 (8)	0.0167 (3)
O8	0.12967 (13)	0.36879 (7)	−0.13883 (9)	0.0202 (3)
C43	−0.1018 (2)	0.27946 (11)	−0.02317 (16)	0.0282 (5)
H43A	−0.0970	0.2337	−0.0198	0.042*
H43B	−0.1712	0.2917	−0.0666	0.042*
H43C	−0.1104	0.2964	0.0310	0.042*
C44	0.0266 (2)	0.27524 (10)	−0.11841 (13)	0.0240 (5)
H44A	−0.0401	0.2845	−0.1664	0.029*
H44B	0.0336	0.2293	−0.1114	0.029*
C45	0.1410 (2)	0.30213 (10)	−0.13309 (15)	0.0262 (5)
H45A	0.2081	0.2907	−0.0863	0.031*
H45B	0.1582	0.2851	−0.1857	0.031*
C46	0.1177 (2)	0.39252 (11)	−0.22184 (13)	0.0248 (5)
H46A	0.1937	0.3875	−0.2397	0.037*
H46B	0.0965	0.4370	−0.2228	0.037*
H46C	0.0546	0.3694	−0.2600	0.037*

Atomic displacement parameters (Å²) top

	U¹¹	U²²	U³³	U¹²	U¹³	U²³
Y1	0.01247 (7)	0.00914 (8)	0.00838 (8)	0.00025 (7)	0.00182 (5)	−0.00003 (7)
O1	0.0170 (6)	0.0207 (8)	0.0167 (7)	0.0037 (5)	0.0054 (5)	0.0078 (6)
O2	0.0152 (6)	0.0161 (7)	0.0142 (6)	0.0027 (5)	0.0042 (5)	0.0025 (5)
C1	0.0159 (8)	0.0102 (9)	0.0128 (9)	−0.0006 (7)	0.0011 (7)	−0.0023 (7)
C2	0.0160 (8)	0.0132 (9)	0.0142 (9)	0.0024 (7)	0.0042 (7)	0.0023 (7)
C3	0.0188 (9)	0.0089 (9)	0.0147 (9)	0.0026 (7)	0.0014 (7)	0.0039 (7)
C4	0.0208 (9)	0.0148 (10)	0.0170 (10)	−0.0025 (7)	0.0030 (7)	0.0012 (7)
C5	0.0341 (11)	0.0146 (10)	0.0161 (10)	0.0003 (8)	0.0065 (8)	0.0017 (8)
C6	0.0385 (12)	0.0139 (10)	0.0152 (10)	0.0037 (9)	−0.0051 (8)	0.0020 (8)
C7	0.0216 (10)	0.0219 (11)	0.0246 (11)	0.0030 (8)	−0.0072 (8)	−0.0003 (9)
C8	0.0172 (9)	0.0204 (10)	0.0223 (11)	0.0031 (8)	0.0015 (8)	0.0008 (8)
C9	0.0257 (10)	0.0146 (10)	0.0105 (9)	0.0024 (8)	0.0039 (7)	0.0008 (7)
C10	0.0295 (11)	0.0166 (11)	0.0222 (11)	0.0019 (8)	0.0024 (8)	0.0005 (8)
C11	0.0394 (13)	0.0201 (12)	0.0270 (12)	−0.0062 (10)	0.0006 (10)	−0.0014 (9)
C12	0.0574 (16)	0.0131 (11)	0.0224 (11)	0.0007 (10)	0.0084 (11)	−0.0019 (9)
C13	0.0459 (14)	0.0199 (12)	0.0282 (12)	0.0130 (10)	0.0114 (10)	0.0013 (9)
C14	0.0296 (11)	0.0201 (11)	0.0248 (11)	0.0067 (9)	0.0075 (9)	0.0015 (9)
O3	0.0183 (6)	0.0141 (7)	0.0135 (6)	0.0028 (5)	−0.0020 (5)	−0.0024 (5)
O4	0.0157 (6)	0.0131 (7)	0.0100 (6)	−0.0020 (5)	0.0015 (5)	−0.0010 (5)
C15	0.0148 (8)	0.0147 (9)	0.0094 (8)	−0.0007 (7)	0.0025 (6)	0.0009 (7)
C16	0.0156 (8)	0.0110 (9)	0.0115 (8)	0.0011 (7)	−0.0002 (6)	−0.0024 (7)
C17	0.0135 (8)	0.0125 (9)	0.0117 (8)	−0.0036 (7)	−0.0007 (6)	0.0002 (7)
C18	0.0165 (8)	0.0160 (10)	0.0162 (9)	0.0001 (7)	0.0000 (7)	−0.0002 (7)
C19	0.0217 (9)	0.0178 (10)	0.0168 (10)	−0.0022 (8)	−0.0028 (7)	0.0032 (8)
C20	0.0237 (9)	0.0232 (11)	0.0106 (9)	−0.0070 (8)	0.0014 (7)	−0.0001 (8)
C21	0.0223 (9)	0.0205 (11)	0.0174 (10)	−0.0010 (8)	0.0057 (7)	−0.0021 (8)
C22	0.0192 (9)	0.0159 (10)	0.0133 (9)	0.0012 (7)	0.0016 (7)	−0.0002 (7)
C23	0.0136 (8)	0.0215 (10)	0.0108 (9)	0.0022 (7)	0.0002 (6)	0.0003 (7)
C24	0.0205 (9)	0.0218 (11)	0.0161 (10)	−0.0039 (8)	0.0057 (7)	−0.0044 (8)
C25	0.0260 (10)	0.0312 (13)	0.0177 (10)	−0.0102 (9)	0.0026 (8)	−0.0002 (9)
C26	0.0167 (9)	0.0478 (16)	0.0193 (11)	−0.0059 (9)	0.0025 (8)	0.0073 (10)
C27	0.0226 (10)	0.0465 (15)	0.0221 (11)	0.0129 (10)	0.0096 (9)	0.0085 (10)
C28	0.0229 (10)	0.0254 (12)	0.0208 (10)	0.0074 (8)	0.0072 (8)	0.0021 (9)
O5	0.0194 (6)	0.0118 (7)	0.0135 (6)	0.0007 (5)	0.0056 (5)	0.0004 (5)
O6	0.0148 (6)	0.0116 (7)	0.0129 (6)	−0.0006 (5)	0.0036 (5)	−0.0006 (5)
C29	0.0113 (7)	0.0142 (9)	0.0085 (8)	−0.0013 (6)	0.0007 (6)	0.0005 (7)
C30	0.0123 (7)	0.0135 (9)	0.0122 (8)	−0.0003 (7)	0.0033 (6)	0.0015 (7)
C31	0.0186 (8)	0.0112 (9)	0.0118 (8)	−0.0023 (6)	0.0034 (7)	0.0020 (7)
C32	0.0178 (8)	0.0195 (10)	0.0138 (9)	0.0002 (8)	0.0046 (7)	0.0003 (8)
C33	0.0191 (9)	0.0204 (11)	0.0188 (10)	−0.0024 (7)	0.0003 (7)	0.0021 (8)
C34	0.0329 (11)	0.0215 (11)	0.0123 (9)	−0.0025 (9)	0.0005 (8)	−0.0008 (8)
C35	0.0347 (12)	0.0292 (13)	0.0157 (10)	0.0017 (9)	0.0107 (9)	−0.0019 (9)
C36	0.0225 (9)	0.0223 (11)	0.0175 (10)	0.0006 (8)	0.0077 (8)	0.0008 (8)
C37	0.0136 (8)	0.0169 (10)	0.0137 (9)	−0.0021 (7)	0.0049 (7)	0.0013 (7)
C38	0.0216 (9)	0.0190 (11)	0.0218 (10)	−0.0032 (8)	−0.0041 (8)	0.0027 (8)
C39	0.0295 (11)	0.0162 (11)	0.0341 (13)	−0.0017 (9)	−0.0041 (9)	0.0080 (9)
C40	0.0248 (10)	0.0160 (11)	0.0313 (12)	−0.0052 (8)	0.0021 (9)	0.0007 (9)
C41	0.0215 (9)	0.0222 (11)	0.0223 (11)	−0.0062 (8)	−0.0008 (8)	0.0005 (9)
C42	0.0180 (9)	0.0174 (10)	0.0179 (10)	−0.0022 (7)	0.0018 (7)	0.0027 (8)
O7	0.0215 (7)	0.0116 (7)	0.0172 (7)	−0.0013 (5)	0.0043 (5)	−0.0027 (5)
O8	0.0310 (8)	0.0142 (7)	0.0180 (7)	0.0020 (6)	0.0112 (6)	−0.0017 (6)
C43	0.0267 (11)	0.0195 (11)	0.0407 (14)	−0.0068 (9)	0.0126 (10)	−0.0046 (10)
C44	0.0341 (11)	0.0172 (11)	0.0206 (11)	0.0000 (9)	0.0057 (9)	−0.0070 (8)
C45	0.0350 (12)	0.0166 (11)	0.0309 (12)	0.0038 (9)	0.0156 (10)	−0.0054 (9)
C46	0.0314 (11)	0.0303 (12)	0.0129 (10)	0.0043 (9)	0.0054 (8)	−0.0031 (9)

Geometric parameters (Å, º) top

Y1—O1	2.3677 (13)	C22—H22	0.9500
Y1—O2	2.4856 (13)	C23—C24	1.387 (3)
Y1—O3	2.4125 (13)	C23—C28	1.394 (3)
Y1—O4	2.5906 (13)	C24—C25	1.390 (3)
Y1—O4ⁱ	2.2874 (13)	C24—H24	0.9500
Y1—O5	2.2894 (13)	C25—C26	1.385 (3)
Y1—O6ⁱ	2.3000 (13)	C25—H25	0.9500
Y1—O7	2.5199 (13)	C26—C27	1.371 (4)
Y1—O8	2.4967 (14)	C26—H26	0.9500
Y1—C1	2.7807 (18)	C27—C28	1.390 (3)
Y1—C15	2.8786 (18)	C27—H27	0.9500
Y1—Y1ⁱ	3.8965 (5)	C28—H28	0.9500
O1—C1	1.263 (2)	O5—C29	1.260 (2)
O2—C1	1.257 (2)	O6—C29	1.253 (2)
C1—C2	1.530 (2)	O6—Y1ⁱ	2.2999 (13)
C2—C3	1.525 (3)	C29—C30	1.539 (2)
C2—C9	1.527 (3)	C30—C37	1.519 (3)
C2—H2	1.0000	C30—C31	1.522 (2)
C3—C4	1.392 (3)	C30—H30	1.0000
C3—C8	1.397 (3)	C31—C36	1.387 (3)
C4—C5	1.395 (3)	C31—C32	1.398 (3)
C4—H4	0.9500	C32—C33	1.392 (3)
C5—C6	1.384 (3)	C32—H32	0.9500
C5—H5	0.9500	C33—C34	1.384 (3)
C6—C7	1.387 (3)	C33—H33	0.9500
C6—H6	0.9500	C34—C35	1.377 (3)
C7—C8	1.388 (3)	C34—H34	0.9500
C7—H7	0.9500	C35—C36	1.393 (3)
C8—H8	0.9500	C35—H35	0.9500
C9—C10	1.392 (3)	C36—H36	0.9500
C9—C14	1.394 (3)	C37—C38	1.385 (3)
C10—C11	1.387 (3)	C37—C42	1.396 (3)
C10—H10	0.9500	C38—C39	1.394 (3)
C11—C12	1.383 (3)	C38—H38	0.9500
C11—H11	0.9500	C39—C40	1.381 (3)
C12—C13	1.376 (4)	C39—H39	0.9500
C12—H12	0.9500	C40—C41	1.382 (3)
C13—C14	1.388 (3)	C40—H40	0.9500
C13—H13	0.9500	C41—C42	1.386 (3)
C14—H14	0.9500	C41—H41	0.9500
O3—C15	1.251 (2)	C42—H42	0.9500
O4—C15	1.272 (2)	O7—C44	1.429 (2)
O4—Y1ⁱ	2.2874 (13)	O7—C43	1.437 (2)
C15—C16	1.522 (2)	O8—C46	1.426 (2)
C16—C17	1.522 (3)	O8—C45	1.432 (3)
C16—C23	1.528 (3)	C43—H43A	0.9800
C16—H16	1.0000	C43—H43B	0.9800
C17—C22	1.386 (3)	C43—H43C	0.9800
C17—C18	1.398 (3)	C44—C45	1.494 (3)
C18—C19	1.382 (3)	C44—H44A	0.9900
C18—H18	0.9500	C44—H44B	0.9900
C19—C20	1.386 (3)	C45—H45A	0.9900
C19—H19	0.9500	C45—H45B	0.9900
C20—C21	1.385 (3)	C46—H46A	0.9800
C20—H20	0.9500	C46—H46B	0.9800
C21—C22	1.395 (3)	C46—H46C	0.9800
C21—H21	0.9500

O4ⁱ—Y1—O5	75.85 (5)	O3—C15—Y1	55.96 (9)
O4ⁱ—Y1—O6ⁱ	75.54 (4)	O4—C15—Y1	64.15 (9)
O5—Y1—O6ⁱ	136.94 (5)	C16—C15—Y1	174.47 (13)
O4ⁱ—Y1—O1	90.95 (5)	C17—C16—C15	115.01 (15)
O5—Y1—O1	83.59 (5)	C17—C16—C23	110.34 (14)
O6ⁱ—Y1—O1	128.20 (5)	C15—C16—C23	109.68 (15)
O4ⁱ—Y1—O3	125.11 (4)	C17—C16—H16	107.2
O5—Y1—O3	92.11 (5)	C15—C16—H16	107.2
O6ⁱ—Y1—O3	78.97 (5)	C23—C16—H16	107.2
O1—Y1—O3	141.52 (5)	C22—C17—C18	118.60 (17)
O4ⁱ—Y1—O2	79.27 (5)	C22—C17—C16	124.27 (16)
O5—Y1—O2	129.58 (4)	C18—C17—C16	117.11 (17)
O6ⁱ—Y1—O2	74.66 (4)	C19—C18—C17	120.94 (18)
O1—Y1—O2	53.61 (4)	C19—C18—H18	119.5
O3—Y1—O2	137.59 (5)	C17—C18—H18	119.5
O4ⁱ—Y1—O8	143.34 (5)	C18—C19—C20	120.23 (18)
O5—Y1—O8	71.00 (5)	C18—C19—H19	119.9
O6ⁱ—Y1—O8	140.75 (5)	C20—C19—H19	119.9
O1—Y1—O8	70.46 (5)	C21—C20—C19	119.36 (18)
O3—Y1—O8	72.00 (5)	C21—C20—H20	120.3
O2—Y1—O8	110.54 (5)	C19—C20—H20	120.3
O4ⁱ—Y1—O7	147.19 (5)	C20—C21—C22	120.45 (19)
O5—Y1—O7	135.93 (5)	C20—C21—H21	119.8
O6ⁱ—Y1—O7	80.73 (4)	C22—C21—H21	119.8
O1—Y1—O7	86.15 (5)	C17—C22—C21	120.40 (18)
O3—Y1—O7	70.63 (4)	C17—C22—H22	119.8
O2—Y1—O7	72.77 (4)	C21—C22—H22	119.8
O8—Y1—O7	65.17 (5)	C24—C23—C28	118.97 (19)
O4ⁱ—Y1—O4	74.14 (5)	C24—C23—C16	121.33 (17)
O5—Y1—O4	70.92 (4)	C28—C23—C16	119.68 (18)
O6ⁱ—Y1—O4	70.72 (4)	C23—C24—C25	120.7 (2)
O1—Y1—O4	152.82 (4)	C23—C24—H24	119.6
O3—Y1—O4	51.63 (4)	C25—C24—H24	119.6
O2—Y1—O4	140.45 (4)	C26—C25—C24	119.5 (2)
O8—Y1—O4	108.30 (4)	C26—C25—H25	120.2
O7—Y1—O4	118.68 (4)	C24—C25—H25	120.2
O4ⁱ—Y1—C1	86.66 (5)	C27—C26—C25	120.4 (2)
O5—Y1—C1	108.19 (5)	C27—C26—H26	119.8
O6ⁱ—Y1—C1	101.53 (5)	C25—C26—H26	119.8
O1—Y1—C1	26.89 (5)	C26—C27—C28	120.3 (2)
O3—Y1—C1	146.29 (5)	C26—C27—H27	119.9
O2—Y1—C1	26.88 (5)	C28—C27—H27	119.9
O8—Y1—C1	89.12 (5)	C27—C28—C23	120.1 (2)
O7—Y1—C1	76.16 (5)	C27—C28—H28	119.9
O4—Y1—C1	160.48 (5)	C23—C28—H28	119.9
O4ⁱ—Y1—C15	99.85 (5)	C29—O5—Y1	137.57 (12)
O5—Y1—C15	81.93 (5)	C29—O6—Y1ⁱ	136.64 (12)
O6ⁱ—Y1—C15	72.10 (5)	O6—C29—O5	126.18 (17)
O1—Y1—C15	159.21 (5)	O6—C29—C30	118.03 (16)
O3—Y1—C15	25.45 (5)	O5—C29—C30	115.74 (16)
O2—Y1—C15	145.79 (5)	C37—C30—C31	113.44 (15)
O8—Y1—C15	90.69 (5)	C37—C30—C29	111.78 (15)
O7—Y1—C15	93.95 (5)	C31—C30—C29	109.21 (14)
O4—Y1—C15	26.23 (5)	C37—C30—H30	107.4
C1—Y1—C15	169.17 (5)	C31—C30—H30	107.4
O4ⁱ—Y1—Y1ⁱ	39.76 (3)	C29—C30—H30	107.4
O5—Y1—Y1ⁱ	68.84 (3)	C36—C31—C32	118.85 (17)
O6ⁱ—Y1—Y1ⁱ	68.53 (3)	C36—C31—C30	119.71 (17)
O1—Y1—Y1ⁱ	126.95 (4)	C32—C31—C30	121.41 (17)
O3—Y1—Y1ⁱ	85.69 (3)	C33—C32—C31	120.47 (18)
O2—Y1—Y1ⁱ	113.78 (3)	C33—C32—H32	119.8
O8—Y1—Y1ⁱ	132.82 (3)	C31—C32—H32	119.8
O7—Y1—Y1ⁱ	144.34 (3)	C34—C33—C32	119.95 (19)
O4—Y1—Y1ⁱ	34.38 (3)	C34—C33—H33	120.0
C1—Y1—Y1ⁱ	126.33 (4)	C32—C33—H33	120.0
C15—Y1—Y1ⁱ	60.27 (4)	C35—C34—C33	119.93 (19)
C1—O1—Y1	95.10 (11)	C35—C34—H34	120.0
C1—O2—Y1	89.76 (11)	C33—C34—H34	120.0
O2—C1—O1	120.80 (16)	C34—C35—C36	120.4 (2)
O2—C1—C2	121.79 (16)	C34—C35—H35	119.8
O1—C1—C2	117.36 (16)	C36—C35—H35	119.8
O2—C1—Y1	63.36 (9)	C31—C36—C35	120.39 (19)
O1—C1—Y1	58.01 (9)	C31—C36—H36	119.8
C2—C1—Y1	169.18 (13)	C35—C36—H36	119.8
C3—C2—C9	110.36 (15)	C38—C37—C42	118.76 (18)
C3—C2—C1	114.78 (15)	C38—C37—C30	122.97 (17)
C9—C2—C1	111.89 (15)	C42—C37—C30	118.26 (17)
C3—C2—H2	106.4	C37—C38—C39	120.31 (19)
C9—C2—H2	106.4	C37—C38—H38	119.8
C1—C2—H2	106.4	C39—C38—H38	119.8
C4—C3—C8	118.67 (18)	C40—C39—C38	120.3 (2)
C4—C3—C2	121.93 (16)	C40—C39—H39	119.8
C8—C3—C2	119.28 (17)	C38—C39—H39	119.8
C3—C4—C5	120.24 (18)	C39—C40—C41	119.9 (2)
C3—C4—H4	119.9	C39—C40—H40	120.1
C5—C4—H4	119.9	C41—C40—H40	120.1
C6—C5—C4	120.5 (2)	C40—C41—C42	119.87 (19)
C6—C5—H5	119.7	C40—C41—H41	120.1
C4—C5—H5	119.7	C42—C41—H41	120.1
C5—C6—C7	119.67 (19)	C41—C42—C37	120.85 (19)
C5—C6—H6	120.2	C41—C42—H42	119.6
C7—C6—H6	120.2	C37—C42—H42	119.6
C6—C7—C8	119.91 (19)	C44—O7—C43	110.76 (16)
C6—C7—H7	120.0	C44—O7—Y1	118.02 (12)
C8—C7—H7	120.0	C43—O7—Y1	120.47 (12)
C7—C8—C3	120.98 (19)	C46—O8—C45	113.88 (16)
C7—C8—H8	119.5	C46—O8—Y1	128.39 (12)
C3—C8—H8	119.5	C45—O8—Y1	113.59 (12)
C10—C9—C14	118.11 (19)	O7—C43—H43A	109.5
C10—C9—C2	123.85 (18)	O7—C43—H43B	109.5
C14—C9—C2	118.03 (18)	H43A—C43—H43B	109.5
C11—C10—C9	120.6 (2)	O7—C43—H43C	109.5
C11—C10—H10	119.7	H43A—C43—H43C	109.5
C9—C10—H10	119.7	H43B—C43—H43C	109.5
C12—C11—C10	120.4 (2)	O7—C44—C45	106.64 (17)
C12—C11—H11	119.8	O7—C44—H44A	110.4
C10—C11—H11	119.8	C45—C44—H44A	110.4
C13—C12—C11	119.8 (2)	O7—C44—H44B	110.4
C13—C12—H12	120.1	C45—C44—H44B	110.4
C11—C12—H12	120.1	H44A—C44—H44B	108.6
C12—C13—C14	119.9 (2)	O8—C45—C44	108.83 (17)
C12—C13—H13	120.1	O8—C45—H45A	109.9
C14—C13—H13	120.1	C44—C45—H45A	109.9
C13—C14—C9	121.2 (2)	O8—C45—H45B	109.9
C13—C14—H14	119.4	C44—C45—H45B	109.9
C9—C14—H14	119.4	H45A—C45—H45B	108.3
C15—O3—Y1	98.58 (11)	O8—C46—H46A	109.5
C15—O4—Y1ⁱ	160.71 (12)	O8—C46—H46B	109.5
C15—O4—Y1	89.62 (11)	H46A—C46—H46B	109.5
Y1ⁱ—O4—Y1	105.86 (5)	O8—C46—H46C	109.5
O3—C15—O4	119.95 (16)	H46A—C46—H46C	109.5
O3—C15—C16	121.67 (16)	H46B—C46—H46C	109.5
O4—C15—C16	118.37 (16)

Y1—O2—C1—O1	8.46 (18)	C19—C20—C21—C22	1.8 (3)
Y1—O2—C1—C2	−169.10 (15)	C18—C17—C22—C21	−0.2 (3)
Y1—O1—C1—O2	−8.92 (19)	C16—C17—C22—C21	177.89 (17)
Y1—O1—C1—C2	168.74 (14)	C20—C21—C22—C17	−0.9 (3)
O2—C1—C2—C3	−54.8 (2)	C17—C16—C23—C24	54.1 (2)
O1—C1—C2—C3	127.59 (18)	C15—C16—C23—C24	−73.6 (2)
Y1—C1—C2—C3	−170.5 (6)	C17—C16—C23—C28	−124.13 (19)
O2—C1—C2—C9	72.0 (2)	C15—C16—C23—C28	108.18 (19)
O1—C1—C2—C9	−105.66 (19)	C28—C23—C24—C25	0.5 (3)
Y1—C1—C2—C9	−43.7 (7)	C16—C23—C24—C25	−177.69 (18)
C9—C2—C3—C4	−70.3 (2)	C23—C24—C25—C26	−0.6 (3)
C1—C2—C3—C4	57.2 (2)	C24—C25—C26—C27	0.2 (3)
C9—C2—C3—C8	105.7 (2)	C25—C26—C27—C28	0.3 (3)
C1—C2—C3—C8	−126.80 (19)	C26—C27—C28—C23	−0.3 (3)
C8—C3—C4—C5	−0.6 (3)	C24—C23—C28—C27	−0.1 (3)
C2—C3—C4—C5	175.47 (18)	C16—C23—C28—C27	178.14 (18)
C3—C4—C5—C6	0.0 (3)	Y1ⁱ—O6—C29—O5	−20.8 (3)
C4—C5—C6—C7	0.6 (3)	Y1ⁱ—O6—C29—C30	156.55 (12)
C5—C6—C7—C8	−0.7 (3)	Y1—O5—C29—O6	6.0 (3)
C6—C7—C8—C3	0.1 (3)	Y1—O5—C29—C30	−171.41 (11)
C4—C3—C8—C7	0.5 (3)	O6—C29—C30—C37	25.6 (2)
C2—C3—C8—C7	−175.61 (18)	O5—C29—C30—C37	−156.81 (15)
C3—C2—C9—C10	107.1 (2)	O6—C29—C30—C31	−100.79 (18)
C1—C2—C9—C10	−22.0 (3)	O5—C29—C30—C31	76.82 (19)
C3—C2—C9—C14	−72.1 (2)	C37—C30—C31—C36	92.7 (2)
C1—C2—C9—C14	158.75 (17)	C29—C30—C31—C36	−141.92 (18)
C14—C9—C10—C11	−1.9 (3)	C37—C30—C31—C32	−85.1 (2)
C2—C9—C10—C11	178.88 (19)	C29—C30—C31—C32	40.3 (2)
C9—C10—C11—C12	0.8 (3)	C36—C31—C32—C33	0.3 (3)
C10—C11—C12—C13	0.8 (4)	C30—C31—C32—C33	178.08 (18)
C11—C12—C13—C14	−1.1 (4)	C31—C32—C33—C34	−0.2 (3)
C12—C13—C14—C9	−0.1 (3)	C32—C33—C34—C35	−0.2 (3)
C10—C9—C14—C13	1.5 (3)	C33—C34—C35—C36	0.5 (3)
C2—C9—C14—C13	−179.18 (19)	C32—C31—C36—C35	0.0 (3)
Y1—O3—C15—O4	4.92 (18)	C30—C31—C36—C35	−177.78 (19)
Y1—O3—C15—C16	−174.04 (14)	C34—C35—C36—C31	−0.4 (3)
Y1ⁱ—O4—C15—O3	−148.5 (3)	C31—C30—C37—C38	13.4 (3)
Y1—O4—C15—O3	−4.53 (17)	C29—C30—C37—C38	−110.6 (2)
Y1ⁱ—O4—C15—C16	30.5 (5)	C31—C30—C37—C42	−167.01 (17)
Y1—O4—C15—C16	174.47 (14)	C29—C30—C37—C42	69.0 (2)
Y1ⁱ—O4—C15—Y1	−144.0 (4)	C42—C37—C38—C39	−1.4 (3)
O3—C15—C16—C17	−56.1 (2)	C30—C37—C38—C39	178.11 (19)
O4—C15—C16—C17	124.89 (18)	C37—C38—C39—C40	0.6 (4)
O3—C15—C16—C23	68.9 (2)	C38—C39—C40—C41	0.5 (4)
O4—C15—C16—C23	−110.07 (19)	C39—C40—C41—C42	−0.6 (3)
C15—C16—C17—C22	26.8 (3)	C40—C41—C42—C37	−0.2 (3)
C23—C16—C17—C22	−97.9 (2)	C38—C37—C42—C41	1.3 (3)
C15—C16—C17—C18	−155.15 (17)	C30—C37—C42—C41	−178.32 (18)
C23—C16—C17—C18	80.2 (2)	C43—O7—C44—C45	−178.48 (17)
C22—C17—C18—C19	0.3 (3)	Y1—O7—C44—C45	36.8 (2)
C16—C17—C18—C19	−177.94 (17)	C46—O8—C45—C44	−106.8 (2)
C17—C18—C19—C20	0.7 (3)	Y1—O8—C45—C44	52.4 (2)
C18—C19—C20—C21	−1.7 (3)	O7—C44—C45—O8	−57.2 (2)

Symmetry code: (i) −x, −y+1, −z.

(mol-3) Tetrakis(methanol-κO)tris(2,2,2-triphenylacetato)-κ⁴O:O';κO-europium(III) methanol disolvate top

Crystal data top

[Eu(C₁₉H₁₅O₂)₃(CH₄O)₄]·2CH₄O	Z = 2
M_r = 1206.17	F(000) = 1248
Triclinic, P1	D_x = 1.424 Mg m⁻³
a = 13.3716 (6) Å	Mo Kα radiation, λ = 0.71073 Å
b = 13.5971 (6) Å	Cell parameters from 874 reflections
c = 17.7021 (7) Å	θ = 2.9–20.7°
α = 93.0794 (8)°	µ = 1.18 mm⁻¹
β = 92.9949 (8)°	T = 120 K
γ = 118.4751 (7)°	Prism, colorless
V = 2813.9 (2) Å³	0.21 × 0.18 × 0.15 mm

Data collection top

Bruker APEXII CCD area-detector diffractometer	17616 independent reflections
Radiation source: fine-focus sealed tube	15258 reflections with I > 2σ(I)
Graphite monochromator	R_int = 0.028
ω scans	θ_max = 31.2°, θ_min = 1.7°
Absorption correction: multi-scan (SADABS; Sheldrick, 1997)	h = −19→19
T_min = 0.451, T_max = 0.533	k = −19→19
32526 measured reflections	l = −25→25

Refinement top

Refinement on F²	Primary atom site location: structure-invariant direct methods
Least-squares matrix: full	Secondary atom site location: difference Fourier map
R[F² > 2σ(F²)] = 0.035	Hydrogen site location: mixed
wR(F²) = 0.075	H atoms treated by a mixture of independent and constrained refinement
S = 1.03	w = 1/[σ²(F_o²) + (0.0306P)² + 0.7894P] where P = (F_o² + 2F_c²)/3
17616 reflections	(Δ/σ)_max = 0.001
742 parameters	Δρ_max = 1.20 e Å⁻³
0 restraints	Δρ_min = −1.11 e Å⁻³

Special details top

Fractional atomic coordinates and isotropic or equivalent isotropic displacement parameters (Å²) top

	x	y	z	U_iso*/U_eq
Eu1	0.15979 (2)	0.62278 (2)	0.28190 (2)	0.01324 (3)
O1	0.09947 (13)	0.67457 (13)	0.40013 (8)	0.0179 (3)
O2	0.02935 (13)	0.70154 (13)	0.29309 (8)	0.0174 (3)
C1	0.05509 (17)	0.72460 (17)	0.36353 (11)	0.0144 (4)
C2	0.03050 (17)	0.81209 (17)	0.40708 (11)	0.0136 (4)
C3	−0.09344 (17)	0.74671 (17)	0.42868 (11)	0.0140 (4)
C4	−0.14929 (19)	0.63010 (19)	0.43102 (12)	0.0190 (4)
H4	−0.1101	0.5891	0.4198	0.023*
C5	−0.2617 (2)	0.5734 (2)	0.44965 (14)	0.0252 (5)
H5	−0.2991	0.4940	0.4498	0.030*
C6	−0.3194 (2)	0.6320 (2)	0.46798 (13)	0.0262 (5)
H6	−0.3961	0.5930	0.4809	0.031*
C7	−0.2646 (2)	0.7475 (2)	0.46731 (13)	0.0241 (5)
H7	−0.3032	0.7883	0.4807	0.029*
C8	−0.15342 (18)	0.80415 (19)	0.44720 (12)	0.0186 (4)
H8	−0.1173	0.8834	0.4460	0.022*
C9	0.11684 (18)	0.86739 (17)	0.47707 (11)	0.0147 (4)
C10	0.08508 (19)	0.88608 (18)	0.54798 (11)	0.0168 (4)
H10	0.0066	0.8589	0.5550	0.020*
C11	0.1675 (2)	0.94440 (19)	0.60871 (12)	0.0206 (4)
H11	0.1444	0.9568	0.6565	0.025*
C12	0.2817 (2)	0.98416 (19)	0.60027 (13)	0.0224 (5)
H12	0.3374	1.0234	0.6419	0.027*
C13	0.31429 (19)	0.96592 (19)	0.52964 (13)	0.0212 (4)
H13	0.3930	0.9938	0.5229	0.025*
C14	0.23294 (18)	0.90738 (18)	0.46909 (12)	0.0187 (4)
H14	0.2565	0.8943	0.4216	0.022*
C15	0.03772 (18)	0.90165 (17)	0.35375 (11)	0.0156 (4)
C16	0.11855 (19)	1.01473 (18)	0.36746 (12)	0.0195 (4)
H16	0.1738	1.0385	0.4099	0.023*
C17	0.1195 (2)	1.0936 (2)	0.31974 (14)	0.0243 (5)
H17	0.1754	1.1703	0.3299	0.029*
C18	0.0397 (2)	1.0609 (2)	0.25778 (13)	0.0255 (5)
H18	0.0400	1.1148	0.2256	0.031*
C19	−0.0405 (2)	0.9486 (2)	0.24333 (12)	0.0225 (5)
H19	−0.0954	0.9252	0.2007	0.027*
C20	−0.04151 (19)	0.87021 (19)	0.29026 (12)	0.0189 (4)
H20	−0.0971	0.7935	0.2792	0.023*
O3	0.31875 (14)	0.66508 (13)	0.20001 (9)	0.0238 (3)
O4	0.20495 (13)	0.48713 (12)	0.20948 (8)	0.0173 (3)
C21	0.28892 (18)	0.56478 (18)	0.18064 (11)	0.0156 (4)
C22	0.35789 (17)	0.53821 (17)	0.12210 (11)	0.0140 (4)
C23	0.29045 (17)	0.41663 (17)	0.08533 (12)	0.0155 (4)
C24	0.25786 (19)	0.32638 (18)	0.13028 (13)	0.0197 (4)
H24	0.2731	0.3407	0.1839	0.024*
C25	0.2036 (2)	0.21635 (19)	0.09784 (15)	0.0258 (5)
H25	0.1830	0.1563	0.1293	0.031*
C26	0.1795 (2)	0.1935 (2)	0.01977 (15)	0.0274 (5)
H26	0.1412	0.1180	−0.0023	0.033*
C27	0.2113 (2)	0.2812 (2)	−0.02571 (14)	0.0251 (5)
H27	0.1953	0.2660	−0.0793	0.030*
C28	0.26692 (19)	0.39190 (18)	0.00664 (12)	0.0191 (4)
H28	0.2892	0.4515	−0.0253	0.023*
C29	0.38388 (18)	0.62202 (17)	0.06131 (11)	0.0147 (4)
C30	0.29533 (19)	0.63661 (19)	0.02821 (13)	0.0208 (4)
H30	0.2215	0.5987	0.0459	0.025*
C31	0.3139 (2)	0.7058 (2)	−0.03014 (13)	0.0252 (5)
H31	0.2526	0.7140	−0.0527	0.030*
C32	0.4216 (2)	0.7631 (2)	−0.05579 (13)	0.0248 (5)
H32	0.4343	0.8105	−0.0958	0.030*
C33	0.5105 (2)	0.75074 (19)	−0.02278 (13)	0.0225 (5)
H33	0.5847	0.7906	−0.0396	0.027*
C34	0.49157 (18)	0.67990 (18)	0.03518 (12)	0.0172 (4)
H34	0.5529	0.6711	0.0570	0.021*
C35	0.47074 (18)	0.55661 (18)	0.16513 (11)	0.0156 (4)
C36	0.51930 (19)	0.48988 (19)	0.14400 (13)	0.0214 (4)
H36	0.4814	0.4311	0.1045	0.026*
C37	0.6221 (2)	0.5078 (2)	0.17968 (14)	0.0272 (5)
H37	0.6535	0.4609	0.1646	0.033*
C38	0.6793 (2)	0.5933 (2)	0.23692 (14)	0.0290 (5)
H38	0.7490	0.6047	0.2620	0.035*
C39	0.6335 (2)	0.6623 (2)	0.25717 (14)	0.0309 (6)
H39	0.6731	0.7225	0.2956	0.037*
C40	0.5299 (2)	0.6441 (2)	0.22175 (13)	0.0240 (5)
H40	0.4993	0.6919	0.2364	0.029*
O5	0.27044 (12)	0.81917 (12)	0.28019 (8)	0.0165 (3)
O6	0.44638 (14)	0.87537 (14)	0.33140 (10)	0.0272 (4)
C41	0.37697 (19)	0.88536 (18)	0.28728 (12)	0.0171 (4)
C42	0.42460 (18)	0.98930 (17)	0.23841 (12)	0.0160 (4)
C43	0.43576 (18)	1.09168 (18)	0.28793 (12)	0.0179 (4)
C44	0.4602 (2)	1.1038 (2)	0.36629 (13)	0.0245 (5)
H44	0.4655	1.0457	0.3906	0.029*
C45	0.4768 (2)	1.1997 (2)	0.40946 (14)	0.0333 (6)
H45	0.4934	1.2062	0.4629	0.040*
C46	0.4697 (2)	1.2852 (2)	0.37565 (15)	0.0325 (6)
H46	0.4804	1.3502	0.4055	0.039*
C47	0.4466 (2)	1.2753 (2)	0.29759 (15)	0.0292 (5)
H47	0.4427	1.3345	0.2737	0.035*
C48	0.4291 (2)	1.17933 (19)	0.25403 (13)	0.0227 (5)
H48	0.4124	1.1731	0.2006	0.027*
C49	0.54334 (18)	1.01141 (18)	0.21733 (12)	0.0167 (4)
C50	0.63972 (19)	1.11643 (19)	0.22936 (12)	0.0195 (4)
H50	0.6336	1.1781	0.2520	0.023*
C51	0.7450 (2)	1.1325 (2)	0.20879 (13)	0.0226 (5)
H51	0.8099	1.2051	0.2173	0.027*
C52	0.7565 (2)	1.0446 (2)	0.17616 (13)	0.0223 (5)
H52	0.8286	1.0563	0.1618	0.027*
C53	0.6610 (2)	0.9383 (2)	0.16442 (13)	0.0240 (5)
H53	0.6681	0.8767	0.1428	0.029*
C54	0.5561 (2)	0.92239 (19)	0.18411 (13)	0.0216 (4)
H54	0.4914	0.8498	0.1750	0.026*
C55	0.34205 (18)	0.96594 (17)	0.16750 (12)	0.0164 (4)
C56	0.23244 (19)	0.95229 (18)	0.17634 (12)	0.0192 (4)
H56	0.2087	0.9534	0.2259	0.023*
C57	0.1585 (2)	0.93715 (19)	0.11344 (14)	0.0234 (5)
H57	0.0846	0.9280	0.1203	0.028*
C58	0.1917 (2)	0.93523 (19)	0.04026 (13)	0.0259 (5)
H58	0.1413	0.9259	−0.0026	0.031*
C59	0.2981 (2)	0.9469 (2)	0.03069 (13)	0.0245 (5)
H59	0.3210	0.9449	−0.0190	0.029*
C60	0.3728 (2)	0.96177 (18)	0.09398 (12)	0.0201 (4)
H60	0.4458	0.9691	0.0866	0.024*
O7	−0.02639 (13)	0.47026 (14)	0.22655 (10)	0.0218 (3)
C61	−0.1402 (2)	0.4455 (2)	0.23538 (19)	0.0403 (7)
H61A	−0.1867	0.4119	0.1870	0.060*
H61B	−0.1420	0.5148	0.2511	0.060*
H61C	−0.1708	0.3925	0.2742	0.060*
H67	−0.022 (3)	0.414 (3)	0.2090 (17)	0.045 (9)*
O8	0.10064 (17)	0.46552 (14)	0.36447 (10)	0.0247 (4)
C62	0.1004 (3)	0.3606 (2)	0.35382 (14)	0.0309 (6)
H62A	0.1126	0.3371	0.4033	0.046*
H62B	0.1617	0.3688	0.3224	0.046*
H62C	0.0267	0.3037	0.3284	0.046*
H68	0.053 (3)	0.455 (3)	0.3878 (18)	0.041 (10)*
O9	0.11955 (16)	0.67201 (16)	0.15301 (9)	0.0239 (4)
C63	0.0128 (2)	0.6550 (2)	0.11778 (14)	0.0345 (6)
H63A	0.0268	0.6999	0.0742	0.052*
H63B	−0.0260	0.6782	0.1546	0.052*
H63C	−0.0354	0.5753	0.1006	0.052*
H69	0.159 (3)	0.734 (3)	0.155 (2)	0.058 (12)*
O10	0.32517 (14)	0.67298 (15)	0.36791 (10)	0.0249 (4)
C64	0.3832 (2)	0.6145 (2)	0.39219 (16)	0.0372 (6)
H64A	0.4634	0.6684	0.4076	0.056*
H64B	0.3788	0.5620	0.3504	0.056*
H64C	0.3474	0.5728	0.4353	0.056*
H70	0.369 (2)	0.741 (2)	0.3623 (15)	0.029 (8)*
O11	0.00619 (15)	0.30455 (15)	0.16548 (10)	0.0275 (4)
C65	−0.0144 (2)	0.3065 (2)	0.08644 (15)	0.0347 (6)
H65A	−0.0960	0.2592	0.0710	0.052*
H65B	0.0295	0.2780	0.0588	0.052*
H65C	0.0092	0.3838	0.0748	0.052*
H71	0.077 (3)	0.347 (2)	0.1752 (16)	0.034 (8)*
O12	0.08411 (16)	0.59867 (16)	0.54888 (11)	0.0296 (4)
C66	0.2001 (3)	0.6769 (2)	0.57513 (18)	0.0437 (8)
H66A	0.2454	0.7021	0.5315	0.066*
H66B	0.2314	0.6405	0.6078	0.066*
H66C	0.2027	0.7418	0.6040	0.066*
H72	0.076 (3)	0.612 (3)	0.5081 (18)	0.042 (10)*

Atomic displacement parameters (Å²) top

	U¹¹	U²²	U³³	U¹²	U¹³	U²³
Eu1	0.01319 (5)	0.01212 (5)	0.01447 (5)	0.00583 (4)	0.00386 (3)	0.00167 (3)
O1	0.0233 (8)	0.0204 (8)	0.0153 (7)	0.0144 (7)	0.0045 (6)	0.0032 (6)
O2	0.0185 (8)	0.0196 (8)	0.0159 (7)	0.0111 (7)	0.0000 (6)	−0.0017 (6)
C1	0.0122 (9)	0.0140 (9)	0.0160 (9)	0.0050 (8)	0.0042 (7)	0.0024 (7)
C2	0.0143 (10)	0.0133 (9)	0.0132 (9)	0.0065 (8)	0.0028 (7)	0.0008 (7)
C3	0.0113 (9)	0.0159 (10)	0.0130 (9)	0.0051 (8)	0.0016 (7)	0.0004 (7)
C4	0.0179 (11)	0.0200 (11)	0.0196 (10)	0.0092 (9)	0.0051 (8)	0.0019 (8)
C5	0.0201 (12)	0.0189 (11)	0.0298 (12)	0.0033 (10)	0.0071 (9)	0.0029 (9)
C6	0.0156 (11)	0.0302 (13)	0.0281 (12)	0.0064 (10)	0.0089 (9)	0.0034 (10)
C7	0.0170 (11)	0.0281 (13)	0.0282 (12)	0.0114 (10)	0.0050 (9)	0.0002 (9)
C8	0.0159 (10)	0.0180 (10)	0.0217 (10)	0.0078 (9)	0.0044 (8)	0.0009 (8)
C9	0.0156 (10)	0.0133 (9)	0.0153 (9)	0.0069 (8)	0.0016 (7)	0.0015 (7)
C10	0.0185 (10)	0.0160 (10)	0.0171 (9)	0.0090 (9)	0.0026 (8)	0.0018 (8)
C11	0.0243 (12)	0.0213 (11)	0.0167 (10)	0.0118 (10)	0.0010 (8)	0.0002 (8)
C12	0.0240 (12)	0.0195 (11)	0.0202 (10)	0.0086 (10)	−0.0055 (9)	0.0002 (8)
C13	0.0156 (11)	0.0211 (11)	0.0239 (11)	0.0063 (9)	0.0005 (8)	0.0046 (9)
C14	0.0159 (10)	0.0192 (11)	0.0192 (10)	0.0068 (9)	0.0032 (8)	0.0020 (8)
C15	0.0174 (10)	0.0160 (10)	0.0158 (9)	0.0097 (9)	0.0044 (8)	0.0014 (7)
C16	0.0193 (11)	0.0174 (10)	0.0205 (10)	0.0076 (9)	0.0036 (8)	0.0013 (8)
C17	0.0235 (12)	0.0172 (11)	0.0322 (12)	0.0088 (10)	0.0100 (10)	0.0062 (9)
C18	0.0335 (14)	0.0286 (13)	0.0261 (12)	0.0221 (12)	0.0144 (10)	0.0146 (10)
C19	0.0272 (12)	0.0308 (13)	0.0171 (10)	0.0197 (11)	0.0029 (9)	0.0058 (9)
C20	0.0193 (11)	0.0184 (10)	0.0204 (10)	0.0105 (9)	0.0017 (8)	0.0004 (8)
O3	0.0235 (9)	0.0143 (8)	0.0317 (9)	0.0064 (7)	0.0150 (7)	0.0009 (6)
O4	0.0162 (7)	0.0134 (7)	0.0210 (7)	0.0053 (6)	0.0085 (6)	0.0027 (6)
C21	0.0144 (10)	0.0168 (10)	0.0168 (9)	0.0082 (9)	0.0035 (8)	0.0016 (8)
C22	0.0133 (10)	0.0132 (9)	0.0161 (9)	0.0064 (8)	0.0043 (7)	0.0020 (7)
C23	0.0112 (9)	0.0133 (9)	0.0222 (10)	0.0057 (8)	0.0042 (8)	0.0009 (8)
C24	0.0205 (11)	0.0177 (10)	0.0244 (11)	0.0112 (9)	0.0074 (9)	0.0045 (8)
C25	0.0253 (12)	0.0151 (11)	0.0391 (14)	0.0102 (10)	0.0101 (10)	0.0062 (9)
C26	0.0224 (12)	0.0171 (11)	0.0396 (14)	0.0077 (10)	0.0033 (10)	−0.0063 (10)
C27	0.0221 (12)	0.0240 (12)	0.0274 (12)	0.0109 (10)	−0.0010 (9)	−0.0078 (9)
C28	0.0193 (11)	0.0172 (10)	0.0207 (10)	0.0085 (9)	0.0041 (8)	0.0004 (8)
C29	0.0157 (10)	0.0110 (9)	0.0171 (9)	0.0061 (8)	0.0036 (8)	0.0002 (7)
C30	0.0169 (11)	0.0228 (11)	0.0250 (11)	0.0110 (9)	0.0038 (9)	0.0033 (9)
C31	0.0271 (13)	0.0255 (12)	0.0281 (12)	0.0171 (11)	−0.0015 (10)	0.0029 (9)
C32	0.0342 (14)	0.0200 (11)	0.0215 (11)	0.0139 (11)	0.0023 (10)	0.0050 (9)
C33	0.0215 (12)	0.0208 (11)	0.0226 (11)	0.0074 (10)	0.0081 (9)	0.0039 (9)
C34	0.0167 (10)	0.0165 (10)	0.0190 (10)	0.0084 (9)	0.0026 (8)	0.0003 (8)
C35	0.0143 (10)	0.0158 (10)	0.0171 (9)	0.0069 (8)	0.0036 (8)	0.0053 (8)
C36	0.0166 (11)	0.0218 (11)	0.0247 (11)	0.0088 (9)	0.0011 (8)	−0.0008 (9)
C37	0.0223 (12)	0.0293 (13)	0.0343 (13)	0.0160 (11)	0.0016 (10)	0.0027 (10)
C38	0.0229 (13)	0.0320 (14)	0.0326 (13)	0.0142 (11)	−0.0059 (10)	0.0040 (10)
C39	0.0299 (14)	0.0312 (14)	0.0269 (12)	0.0129 (12)	−0.0090 (10)	−0.0065 (10)
C40	0.0253 (12)	0.0256 (12)	0.0228 (11)	0.0144 (11)	−0.0011 (9)	−0.0018 (9)
O5	0.0148 (7)	0.0132 (7)	0.0205 (7)	0.0056 (6)	0.0043 (6)	0.0023 (6)
O6	0.0197 (8)	0.0232 (9)	0.0302 (9)	0.0032 (7)	−0.0029 (7)	0.0116 (7)
C41	0.0192 (11)	0.0140 (10)	0.0166 (9)	0.0063 (9)	0.0041 (8)	0.0017 (8)
C42	0.0144 (10)	0.0143 (10)	0.0171 (9)	0.0048 (8)	0.0027 (8)	0.0027 (7)
C43	0.0143 (10)	0.0153 (10)	0.0200 (10)	0.0037 (8)	0.0036 (8)	0.0007 (8)
C44	0.0260 (12)	0.0225 (12)	0.0208 (11)	0.0081 (10)	0.0046 (9)	0.0023 (9)
C45	0.0375 (15)	0.0324 (14)	0.0225 (12)	0.0111 (13)	0.0052 (11)	−0.0049 (10)
C46	0.0302 (14)	0.0212 (12)	0.0388 (14)	0.0067 (11)	0.0116 (11)	−0.0074 (10)
C47	0.0275 (13)	0.0187 (12)	0.0403 (14)	0.0105 (11)	0.0045 (11)	−0.0010 (10)
C48	0.0237 (12)	0.0182 (11)	0.0240 (11)	0.0083 (10)	0.0015 (9)	0.0013 (9)
C49	0.0153 (10)	0.0163 (10)	0.0166 (9)	0.0056 (9)	0.0033 (8)	0.0055 (8)
C50	0.0184 (11)	0.0172 (10)	0.0205 (10)	0.0064 (9)	0.0022 (8)	0.0031 (8)
C51	0.0180 (11)	0.0216 (11)	0.0244 (11)	0.0062 (10)	0.0023 (9)	0.0051 (9)
C52	0.0186 (11)	0.0275 (12)	0.0229 (11)	0.0117 (10)	0.0059 (9)	0.0090 (9)
C53	0.0240 (12)	0.0232 (12)	0.0273 (12)	0.0132 (10)	0.0035 (9)	0.0022 (9)
C54	0.0192 (11)	0.0157 (10)	0.0271 (11)	0.0063 (9)	0.0014 (9)	0.0011 (8)
C55	0.0171 (10)	0.0110 (9)	0.0182 (10)	0.0043 (8)	0.0011 (8)	0.0022 (7)
C56	0.0215 (11)	0.0151 (10)	0.0211 (10)	0.0087 (9)	0.0037 (8)	0.0028 (8)
C57	0.0217 (12)	0.0174 (11)	0.0322 (12)	0.0109 (10)	−0.0029 (9)	0.0008 (9)
C58	0.0317 (13)	0.0185 (11)	0.0259 (12)	0.0126 (11)	−0.0107 (10)	−0.0022 (9)
C59	0.0320 (13)	0.0225 (12)	0.0179 (10)	0.0124 (11)	−0.0001 (9)	0.0018 (9)
C60	0.0217 (11)	0.0162 (10)	0.0214 (10)	0.0080 (9)	0.0041 (9)	0.0040 (8)
O7	0.0141 (8)	0.0159 (8)	0.0333 (9)	0.0058 (7)	0.0020 (6)	−0.0015 (7)
C61	0.0161 (12)	0.0317 (15)	0.067 (2)	0.0084 (12)	0.0036 (12)	−0.0149 (14)
O8	0.0332 (10)	0.0167 (8)	0.0249 (9)	0.0111 (8)	0.0112 (8)	0.0077 (7)
C62	0.0519 (17)	0.0181 (12)	0.0255 (12)	0.0178 (12)	0.0100 (11)	0.0084 (9)
O9	0.0282 (10)	0.0216 (9)	0.0206 (8)	0.0105 (8)	0.0034 (7)	0.0038 (7)
C63	0.0392 (16)	0.0311 (14)	0.0247 (12)	0.0111 (13)	−0.0107 (11)	0.0045 (10)
O10	0.0174 (8)	0.0196 (9)	0.0355 (9)	0.0065 (7)	−0.0001 (7)	0.0107 (7)
C64	0.0360 (16)	0.0395 (16)	0.0420 (16)	0.0231 (14)	−0.0020 (12)	0.0087 (12)
O11	0.0165 (9)	0.0218 (9)	0.0370 (10)	0.0036 (7)	0.0065 (7)	−0.0043 (7)
C65	0.0243 (13)	0.0417 (16)	0.0366 (14)	0.0170 (13)	−0.0046 (11)	−0.0126 (12)
O12	0.0318 (10)	0.0299 (10)	0.0237 (9)	0.0115 (8)	0.0037 (8)	0.0074 (8)
C66	0.0419 (17)	0.0285 (15)	0.0506 (18)	0.0098 (13)	−0.0143 (14)	0.0111 (13)

Geometric parameters (Å, º) top

Eu1—O1	2.4671 (14)	C35—C36	1.391 (3)
Eu1—O2	2.4542 (14)	C35—C40	1.392 (3)
Eu1—O3	2.4892 (16)	C36—C37	1.386 (3)
Eu1—O4	2.5098 (14)	C36—H36	0.9500
Eu1—O5	2.3594 (15)	C37—C38	1.381 (3)
Eu1—O7	2.4622 (16)	C37—H37	0.9500
Eu1—O8	2.4855 (17)	C38—C39	1.385 (4)
Eu1—O9	2.5145 (16)	C38—H38	0.9500
Eu1—O10	2.4025 (16)	C39—C40	1.393 (3)
Eu1—C1	2.795 (2)	C39—H39	0.9500
Eu1—C21	2.879 (2)	C40—H40	0.9500
Eu1—H69	2.77 (4)	O5—C41	1.266 (3)
Eu1—H70	2.74 (3)	O6—C41	1.243 (3)
O1—C1	1.275 (2)	C41—C42	1.575 (3)
O2—C1	1.258 (2)	C42—C49	1.539 (3)
C1—C2	1.555 (3)	C42—C55	1.540 (3)
C2—C9	1.535 (3)	C42—C43	1.545 (3)
C2—C3	1.543 (3)	C43—C44	1.391 (3)
C2—C15	1.551 (3)	C43—C48	1.400 (3)
C3—C4	1.398 (3)	C44—C45	1.390 (3)
C3—C8	1.399 (3)	C44—H44	0.9500
C4—C5	1.391 (3)	C45—C46	1.377 (4)
C4—H4	0.9500	C45—H45	0.9500
C5—C6	1.385 (3)	C46—C47	1.385 (4)
C5—H5	0.9500	C46—H46	0.9500
C6—C7	1.383 (3)	C47—C48	1.391 (3)
C6—H6	0.9500	C47—H47	0.9500
C7—C8	1.386 (3)	C48—H48	0.9500
C7—H7	0.9500	C49—C50	1.389 (3)
C8—H8	0.9500	C49—C54	1.404 (3)
C9—C10	1.395 (3)	C50—C51	1.390 (3)
C9—C14	1.397 (3)	C50—H50	0.9500
C10—C11	1.397 (3)	C51—C52	1.377 (3)
C10—H10	0.9500	C51—H51	0.9500
C11—C12	1.375 (3)	C52—C53	1.394 (3)
C11—H11	0.9500	C52—H52	0.9500
C12—C13	1.393 (3)	C53—C54	1.380 (3)
C12—H12	0.9500	C53—H53	0.9500
C13—C14	1.388 (3)	C54—H54	0.9500
C13—H13	0.9500	C55—C60	1.391 (3)
C14—H14	0.9500	C55—C56	1.405 (3)
C15—C16	1.392 (3)	C56—C57	1.388 (3)
C15—C20	1.400 (3)	C56—H56	0.9500
C16—C17	1.396 (3)	C57—C58	1.394 (3)
C16—H16	0.9500	C57—H57	0.9500
C17—C18	1.382 (3)	C58—C59	1.374 (3)
C17—H17	0.9500	C58—H58	0.9500
C18—C19	1.384 (3)	C59—C60	1.400 (3)
C18—H18	0.9500	C59—H59	0.9500
C19—C20	1.382 (3)	C60—H60	0.9500
C19—H19	0.9500	O7—C61	1.412 (3)
C20—H20	0.9500	O7—H67	0.84 (3)
O3—C21	1.246 (2)	C61—H61A	0.9800
O4—C21	1.274 (3)	C61—H61B	0.9800
C21—C22	1.559 (3)	C61—H61C	0.9800
C22—C29	1.540 (3)	O8—C62	1.428 (3)
C22—C23	1.540 (3)	O8—H68	0.73 (3)
C22—C35	1.555 (3)	C62—H62A	0.9800
C23—C28	1.398 (3)	C62—H62B	0.9800
C23—C24	1.400 (3)	C62—H62C	0.9800
C24—C25	1.387 (3)	O9—C63	1.434 (3)
C24—H24	0.9500	O9—H69	0.74 (4)
C25—C26	1.386 (4)	C63—H63A	0.9800
C25—H25	0.9500	C63—H63B	0.9800
C26—C27	1.380 (4)	C63—H63C	0.9800
C26—H26	0.9500	O10—C64	1.417 (3)
C27—C28	1.394 (3)	O10—H70	0.84 (3)
C27—H27	0.9500	C64—H64A	0.9800
C28—H28	0.9500	C64—H64B	0.9800
C29—C34	1.391 (3)	C64—H64C	0.9800
C29—C30	1.396 (3)	O11—C65	1.416 (3)
C30—C31	1.386 (3)	O11—H71	0.84 (3)
C30—H30	0.9500	C65—H65A	0.9800
C31—C32	1.387 (4)	C65—H65B	0.9800
C31—H31	0.9500	C65—H65C	0.9800
C32—C33	1.381 (3)	O12—C66	1.432 (3)
C32—H32	0.9500	O12—H72	0.76 (3)
C33—C34	1.395 (3)	C66—H66A	0.9800
C33—H33	0.9500	C66—H66B	0.9800
C34—H34	0.9500	C66—H66C	0.9800

O5—Eu1—O10	75.49 (5)	C25—C24—H24	119.5
O5—Eu1—O2	72.99 (5)	C23—C24—H24	119.5
O10—Eu1—O2	124.80 (5)	C26—C25—C24	120.4 (2)
O5—Eu1—O7	138.49 (5)	C26—C25—H25	119.8
O10—Eu1—O7	145.92 (6)	C24—C25—H25	119.8
O2—Eu1—O7	75.74 (5)	C27—C26—C25	119.6 (2)
O5—Eu1—O1	83.17 (5)	C27—C26—H26	120.2
O10—Eu1—O1	79.39 (6)	C25—C26—H26	120.2
O2—Eu1—O1	52.99 (5)	C26—C27—C28	120.2 (2)
O7—Eu1—O1	99.13 (5)	C26—C27—H27	119.9
O5—Eu1—O8	143.87 (5)	C28—C27—H27	119.9
O10—Eu1—O8	75.01 (6)	C27—C28—C23	121.1 (2)
O2—Eu1—O8	108.30 (6)	C27—C28—H28	119.5
O7—Eu1—O8	72.39 (6)	C23—C28—H28	119.5
O1—Eu1—O8	71.28 (5)	C34—C29—C30	118.4 (2)
O5—Eu1—O3	70.74 (5)	C34—C29—C22	122.33 (18)
O10—Eu1—O3	74.56 (6)	C30—C29—C22	119.16 (19)
O2—Eu1—O3	131.68 (5)	C31—C30—C29	120.8 (2)
O7—Eu1—O3	113.98 (5)	C31—C30—H30	119.6
O1—Eu1—O3	146.81 (5)	C29—C30—H30	119.6
O8—Eu1—O3	119.86 (6)	C30—C31—C32	120.3 (2)
O5—Eu1—O4	122.48 (5)	C30—C31—H31	119.8
O10—Eu1—O4	88.38 (5)	C32—C31—H31	119.8
O2—Eu1—O4	146.81 (5)	C33—C32—C31	119.5 (2)
O7—Eu1—O4	74.90 (5)	C33—C32—H32	120.2
O1—Eu1—O4	147.90 (5)	C31—C32—H32	120.2
O8—Eu1—O4	76.93 (5)	C32—C33—C34	120.2 (2)
O3—Eu1—O4	51.74 (5)	C32—C33—H33	119.9
O5—Eu1—O9	72.57 (6)	C34—C33—H33	119.9
O10—Eu1—O9	136.78 (6)	C29—C34—C33	120.7 (2)
O2—Eu1—O9	71.52 (5)	C29—C34—H34	119.6
O7—Eu1—O9	72.07 (6)	C33—C34—H34	119.6
O1—Eu1—O9	123.88 (5)	C36—C35—C40	118.1 (2)
O8—Eu1—O9	143.20 (6)	C36—C35—C22	120.23 (18)
O3—Eu1—O9	67.91 (6)	C40—C35—C22	121.49 (18)
O4—Eu1—O9	84.95 (5)	C37—C36—C35	121.1 (2)
O5—Eu1—C1	71.71 (6)	C37—C36—H36	119.5
O10—Eu1—C1	100.10 (6)	C35—C36—H36	119.5
O2—Eu1—C1	26.73 (5)	C38—C37—C36	120.5 (2)
O7—Eu1—C1	91.60 (6)	C38—C37—H37	119.7
O1—Eu1—C1	27.15 (5)	C36—C37—H37	119.7
O8—Eu1—C1	93.48 (6)	C37—C38—C39	119.0 (2)
O3—Eu1—C1	142.20 (6)	C37—C38—H38	120.5
O4—Eu1—C1	165.23 (5)	C39—C38—H38	120.5
O9—Eu1—C1	96.73 (6)	C38—C39—C40	120.6 (2)
O5—Eu1—C21	96.27 (6)	C38—C39—H39	119.7
O10—Eu1—C21	81.51 (6)	C40—C39—H39	119.7
O2—Eu1—C21	145.45 (5)	C35—C40—C39	120.6 (2)
O7—Eu1—C21	94.22 (6)	C35—C40—H40	119.7
O1—Eu1—C21	160.41 (5)	C39—C40—H40	119.7
O8—Eu1—C21	99.55 (6)	C41—O5—Eu1	132.95 (13)
O3—Eu1—C21	25.55 (5)	O6—C41—O5	124.5 (2)
O4—Eu1—C21	26.23 (5)	O6—C41—C42	117.70 (19)
O9—Eu1—C21	73.94 (6)	O5—C41—C42	117.80 (18)
C1—Eu1—C21	166.82 (6)	C49—C42—C55	111.90 (17)
O5—Eu1—H69	57.4 (7)	C49—C42—C43	109.74 (17)
O10—Eu1—H69	124.6 (8)	C55—C42—C43	109.21 (17)
O2—Eu1—H69	69.6 (8)	C49—C42—C41	107.37 (16)
O7—Eu1—H69	86.5 (8)	C55—C42—C41	110.42 (17)
O1—Eu1—H69	118.0 (8)	C43—C42—C41	108.11 (17)
O8—Eu1—H69	158.4 (8)	C44—C43—C48	117.9 (2)
O3—Eu1—H69	64.3 (8)	C44—C43—C42	121.7 (2)
O4—Eu1—H69	93.4 (7)	C48—C43—C42	120.31 (19)
O9—Eu1—H69	15.2 (7)	C45—C44—C43	120.9 (2)
C1—Eu1—H69	91.7 (8)	C45—C44—H44	119.5
C21—Eu1—H69	76.9 (8)	C43—C44—H44	119.5
O5—Eu1—H70	58.4 (6)	C46—C45—C44	120.8 (2)
O10—Eu1—H70	17.3 (6)	C46—C45—H45	119.6
O2—Eu1—H70	116.3 (6)	C44—C45—H45	119.6
O7—Eu1—H70	163.1 (6)	C45—C46—C47	119.2 (2)
O1—Eu1—H70	81.1 (6)	C45—C46—H46	120.4
O8—Eu1—H70	91.9 (6)	C47—C46—H46	120.4
O3—Eu1—H70	68.0 (6)	C46—C47—C48	120.4 (2)
O4—Eu1—H70	95.8 (6)	C46—C47—H47	119.8
O9—Eu1—H70	121.9 (6)	C48—C47—H47	119.8
C1—Eu1—H70	95.7 (6)	C47—C48—C43	120.8 (2)
C21—Eu1—H70	82.0 (6)	C47—C48—H48	119.6
H69—Eu1—H70	108.4 (10)	C43—C48—H48	119.6
C1—O1—Eu1	90.88 (12)	C50—C49—C54	117.8 (2)
C1—O2—Eu1	91.90 (11)	C50—C49—C42	122.96 (19)
O2—C1—O1	120.17 (18)	C54—C49—C42	119.25 (19)
O2—C1—C2	120.41 (17)	C49—C50—C51	120.9 (2)
O1—C1—C2	119.41 (17)	C49—C50—H50	119.6
O2—C1—Eu1	61.37 (10)	C51—C50—H50	119.6
O1—C1—Eu1	61.97 (10)	C52—C51—C50	120.8 (2)
C2—C1—Eu1	163.35 (14)	C52—C51—H51	119.6
C9—C2—C3	112.24 (16)	C50—C51—H51	119.6
C9—C2—C15	110.66 (17)	C51—C52—C53	119.1 (2)
C3—C2—C15	108.37 (16)	C51—C52—H52	120.4
C9—C2—C1	109.52 (16)	C53—C52—H52	120.4
C3—C2—C1	106.17 (16)	C54—C53—C52	120.1 (2)
C15—C2—C1	109.76 (16)	C54—C53—H53	119.9
C4—C3—C8	117.82 (19)	C52—C53—H53	119.9
C4—C3—C2	122.12 (18)	C53—C54—C49	121.2 (2)
C8—C3—C2	120.06 (18)	C53—C54—H54	119.4
C5—C4—C3	120.7 (2)	C49—C54—H54	119.4
C5—C4—H4	119.6	C60—C55—C56	117.86 (19)
C3—C4—H4	119.6	C60—C55—C42	122.66 (19)
C6—C5—C4	120.5 (2)	C56—C55—C42	119.43 (18)
C6—C5—H5	119.7	C57—C56—C55	120.7 (2)
C4—C5—H5	119.7	C57—C56—H56	119.6
C7—C6—C5	119.4 (2)	C55—C56—H56	119.6
C7—C6—H6	120.3	C56—C57—C58	120.5 (2)
C5—C6—H6	120.3	C56—C57—H57	119.8
C6—C7—C8	120.3 (2)	C58—C57—H57	119.8
C6—C7—H7	119.9	C59—C58—C57	119.5 (2)
C8—C7—H7	119.9	C59—C58—H58	120.3
C7—C8—C3	121.2 (2)	C57—C58—H58	120.3
C7—C8—H8	119.4	C58—C59—C60	120.2 (2)
C3—C8—H8	119.4	C58—C59—H59	119.9
C10—C9—C14	118.05 (19)	C60—C59—H59	119.9
C10—C9—C2	122.58 (19)	C55—C60—C59	121.3 (2)
C14—C9—C2	119.25 (18)	C55—C60—H60	119.4
C9—C10—C11	120.7 (2)	C59—C60—H60	119.4
C9—C10—H10	119.7	C61—O7—Eu1	133.00 (15)
C11—C10—H10	119.7	C61—O7—H67	112 (2)
C12—C11—C10	120.9 (2)	Eu1—O7—H67	112 (2)
C12—C11—H11	119.5	O7—C61—H61A	109.5
C10—C11—H11	119.5	O7—C61—H61B	109.5
C11—C12—C13	118.8 (2)	H61A—C61—H61B	109.5
C11—C12—H12	120.6	O7—C61—H61C	109.5
C13—C12—H12	120.6	H61A—C61—H61C	109.5
C14—C13—C12	120.6 (2)	H61B—C61—H61C	109.5
C14—C13—H13	119.7	C62—O8—Eu1	130.82 (14)
C12—C13—H13	119.7	C62—O8—H68	105 (3)
C13—C14—C9	120.9 (2)	Eu1—O8—H68	117 (3)
C13—C14—H14	119.6	O8—C62—H62A	109.5
C9—C14—H14	119.6	O8—C62—H62B	109.5
C16—C15—C20	117.59 (19)	H62A—C62—H62B	109.5
C16—C15—C2	122.60 (18)	O8—C62—H62C	109.5
C20—C15—C2	119.77 (19)	H62A—C62—H62C	109.5
C15—C16—C17	120.9 (2)	H62B—C62—H62C	109.5
C15—C16—H16	119.6	C63—O9—Eu1	128.37 (15)
C17—C16—H16	119.6	C63—O9—H69	106 (3)
C18—C17—C16	120.6 (2)	Eu1—O9—H69	102 (3)
C18—C17—H17	119.7	O9—C63—H63A	109.5
C16—C17—H17	119.7	O9—C63—H63B	109.5
C17—C18—C19	119.0 (2)	H63A—C63—H63B	109.5
C17—C18—H18	120.5	O9—C63—H63C	109.5
C19—C18—H18	120.5	H63A—C63—H63C	109.5
C20—C19—C18	120.7 (2)	H63B—C63—H63C	109.5
C20—C19—H19	119.7	C64—O10—Eu1	133.67 (16)
C18—C19—H19	119.7	C64—O10—H70	113.2 (19)
C19—C20—C15	121.3 (2)	Eu1—O10—H70	104.8 (19)
C19—C20—H20	119.4	O10—C64—H64A	109.5
C15—C20—H20	119.4	O10—C64—H64B	109.5
C21—O3—Eu1	94.97 (13)	H64A—C64—H64B	109.5
C21—O4—Eu1	93.26 (12)	O10—C64—H64C	109.5
O3—C21—O4	119.85 (19)	H64A—C64—H64C	109.5
O3—C21—C22	118.37 (19)	H64B—C64—H64C	109.5
O4—C21—C22	121.78 (18)	C65—O11—H71	105 (2)
O3—C21—Eu1	59.48 (11)	O11—C65—H65A	109.5
O4—C21—Eu1	60.51 (10)	O11—C65—H65B	109.5
C22—C21—Eu1	176.33 (14)	H65A—C65—H65B	109.5
C29—C22—C23	110.42 (16)	O11—C65—H65C	109.5
C29—C22—C35	110.35 (17)	H65A—C65—H65C	109.5
C23—C22—C35	109.75 (16)	H65B—C65—H65C	109.5
C29—C22—C21	106.85 (16)	C66—O12—H72	105 (2)
C23—C22—C21	111.74 (17)	O12—C66—H66A	109.5
C35—C22—C21	107.66 (16)	O12—C66—H66B	109.5
C28—C23—C24	117.66 (19)	H66A—C66—H66B	109.5
C28—C23—C22	122.03 (19)	O12—C66—H66C	109.5
C24—C23—C22	120.15 (19)	H66A—C66—H66C	109.5
C25—C24—C23	121.1 (2)	H66B—C66—H66C	109.5

Eu1—O2—C1—O1	−20.5 (2)	C23—C22—C29—C34	−104.0 (2)
Eu1—O2—C1—C2	160.96 (17)	C35—C22—C29—C34	17.5 (3)
Eu1—O1—C1—O2	20.4 (2)	C21—C22—C29—C34	134.24 (19)
Eu1—O1—C1—C2	−161.06 (16)	C23—C22—C29—C30	72.6 (2)
O2—C1—C2—C9	−152.10 (19)	C35—C22—C29—C30	−165.87 (18)
O1—C1—C2—C9	29.4 (3)	C21—C22—C29—C30	−49.1 (2)
Eu1—C1—C2—C9	−60.8 (5)	C34—C29—C30—C31	1.0 (3)
O2—C1—C2—C3	86.5 (2)	C22—C29—C30—C31	−175.8 (2)
O1—C1—C2—C3	−92.0 (2)	C29—C30—C31—C32	−1.0 (3)
Eu1—C1—C2—C3	177.8 (4)	C30—C31—C32—C33	0.0 (4)
O2—C1—C2—C15	−30.4 (3)	C31—C32—C33—C34	0.9 (3)
O1—C1—C2—C15	151.03 (19)	C30—C29—C34—C33	0.0 (3)
Eu1—C1—C2—C15	60.9 (5)	C22—C29—C34—C33	176.63 (19)
C9—C2—C3—C4	−99.6 (2)	C32—C33—C34—C29	−0.9 (3)
C15—C2—C3—C4	137.87 (19)	C29—C22—C35—C36	−97.3 (2)
C1—C2—C3—C4	20.0 (2)	C23—C22—C35—C36	24.6 (3)
C9—C2—C3—C8	80.0 (2)	C21—C22—C35—C36	146.5 (2)
C15—C2—C3—C8	−42.5 (2)	C29—C22—C35—C40	78.3 (2)
C1—C2—C3—C8	−160.38 (18)	C23—C22—C35—C40	−159.8 (2)
C8—C3—C4—C5	1.3 (3)	C21—C22—C35—C40	−38.0 (3)
C2—C3—C4—C5	−179.05 (19)	C40—C35—C36—C37	1.8 (3)
C3—C4—C5—C6	−1.5 (3)	C22—C35—C36—C37	177.5 (2)
C4—C5—C6—C7	0.3 (4)	C35—C36—C37—C38	−0.5 (4)
C5—C6—C7—C8	1.1 (4)	C36—C37—C38—C39	−1.2 (4)
C6—C7—C8—C3	−1.3 (3)	C37—C38—C39—C40	1.6 (4)
C4—C3—C8—C7	0.1 (3)	C36—C35—C40—C39	−1.4 (4)
C2—C3—C8—C7	−179.56 (19)	C22—C35—C40—C39	−177.0 (2)
C3—C2—C9—C10	−18.8 (3)	C38—C39—C40—C35	−0.2 (4)
C15—C2—C9—C10	102.4 (2)	Eu1—O5—C41—O6	−37.6 (3)
C1—C2—C9—C10	−136.4 (2)	Eu1—O5—C41—C42	144.02 (14)
C3—C2—C9—C14	165.44 (18)	O6—C41—C42—C49	35.6 (2)
C15—C2—C9—C14	−73.4 (2)	O5—C41—C42—C49	−145.93 (18)
C1—C2—C9—C14	47.8 (2)	O6—C41—C42—C55	157.86 (19)
C14—C9—C10—C11	0.8 (3)	O5—C41—C42—C55	−23.7 (3)
C2—C9—C10—C11	−175.03 (19)	O6—C41—C42—C43	−82.7 (2)
C9—C10—C11—C12	−0.4 (3)	O5—C41—C42—C43	95.7 (2)
C10—C11—C12—C13	0.4 (3)	C49—C42—C43—C44	−85.6 (2)
C11—C12—C13—C14	−0.8 (3)	C55—C42—C43—C44	151.4 (2)
C12—C13—C14—C9	1.3 (3)	C41—C42—C43—C44	31.2 (3)
C10—C9—C14—C13	−1.3 (3)	C49—C42—C43—C48	90.0 (2)
C2—C9—C14—C13	174.73 (19)	C55—C42—C43—C48	−33.0 (3)
C9—C2—C15—C16	4.1 (3)	C41—C42—C43—C48	−153.2 (2)
C3—C2—C15—C16	127.6 (2)	C48—C43—C44—C45	0.3 (4)
C1—C2—C15—C16	−116.9 (2)	C42—C43—C44—C45	176.0 (2)
C9—C2—C15—C20	−173.79 (18)	C43—C44—C45—C46	0.0 (4)
C3—C2—C15—C20	−50.3 (2)	C44—C45—C46—C47	−0.6 (4)
C1—C2—C15—C20	65.2 (2)	C45—C46—C47—C48	1.0 (4)
C20—C15—C16—C17	0.5 (3)	C46—C47—C48—C43	−0.8 (4)
C2—C15—C16—C17	−177.4 (2)	C44—C43—C48—C47	0.1 (3)
C15—C16—C17—C18	0.1 (3)	C42—C43—C48—C47	−175.7 (2)
C16—C17—C18—C19	−0.6 (3)	C55—C42—C49—C50	109.9 (2)
C17—C18—C19—C20	0.4 (3)	C43—C42—C49—C50	−11.5 (3)
C18—C19—C20—C15	0.3 (3)	C41—C42—C49—C50	−128.8 (2)
C16—C15—C20—C19	−0.7 (3)	C55—C42—C49—C54	−69.9 (2)
C2—C15—C20—C19	177.30 (19)	C43—C42—C49—C54	168.73 (19)
Eu1—O3—C21—O4	−4.4 (2)	C41—C42—C49—C54	51.4 (2)
Eu1—O3—C21—C22	176.59 (15)	C54—C49—C50—C51	0.3 (3)
Eu1—O4—C21—O3	4.4 (2)	C42—C49—C50—C51	−179.45 (19)
Eu1—O4—C21—C22	−176.67 (16)	C49—C50—C51—C52	−0.2 (3)
O3—C21—C22—C29	−41.0 (2)	C50—C51—C52—C53	−0.5 (3)
O4—C21—C22—C29	140.01 (19)	C51—C52—C53—C54	1.1 (3)
O3—C21—C22—C23	−161.90 (18)	C52—C53—C54—C49	−1.1 (3)
O4—C21—C22—C23	19.1 (3)	C50—C49—C54—C53	0.4 (3)
O3—C21—C22—C35	77.5 (2)	C42—C49—C54—C53	−179.9 (2)
O4—C21—C22—C35	−101.5 (2)	C49—C42—C55—C60	2.2 (3)
C29—C22—C23—C28	4.6 (3)	C43—C42—C55—C60	124.0 (2)
C35—C22—C23—C28	−117.3 (2)	C41—C42—C55—C60	−117.3 (2)
C21—C22—C23—C28	123.4 (2)	C49—C42—C55—C56	−175.28 (18)
C29—C22—C23—C24	179.83 (18)	C43—C42—C55—C56	−53.6 (3)
C35—C22—C23—C24	58.0 (2)	C41—C42—C55—C56	65.2 (2)
C21—C22—C23—C24	−61.4 (2)	C60—C55—C56—C57	−1.1 (3)
C28—C23—C24—C25	−0.3 (3)	C42—C55—C56—C57	176.53 (19)
C22—C23—C24—C25	−175.8 (2)	C55—C56—C57—C58	0.0 (3)
C23—C24—C25—C26	−0.7 (3)	C56—C57—C58—C59	0.9 (3)
C24—C25—C26—C27	1.0 (4)	C57—C58—C59—C60	−0.6 (3)
C25—C26—C27—C28	−0.3 (4)	C56—C55—C60—C59	1.4 (3)
C26—C27—C28—C23	−0.7 (3)	C42—C55—C60—C59	−176.2 (2)
C24—C23—C28—C27	1.0 (3)	C58—C59—C60—C55	−0.5 (3)
C22—C23—C28—C27	176.4 (2)

Hydrogen-bond geometry (Å, º) top

D—H···A	D—H	H···A	D···A	D—H···A
O7—H67···O11	0.84 (3)	1.84 (3)	2.676 (2)	172 (3)
O8—H68···O12ⁱ	0.73 (3)	2.05 (3)	2.775 (3)	171 (4)
O10—H70···O6	0.84 (3)	1.75 (3)	2.582 (2)	168 (3)
O11—H71···O4	0.84 (3)	1.89 (3)	2.668 (2)	152 (3)
O12—H72···O1	0.76 (3)	2.11 (3)	2.861 (2)	166 (3)
C61—H61B···O2	0.98	2.51	3.187 (3)	126
C62—H62B···O4	0.98	2.55	3.162 (3)	121
C63—H63B···O2	0.98	2.48	3.109 (3)	121

Symmetry code: (i) −x, −y+1, −z+1.

Selected bond lengths (Å) for (I) and (II) top

	(I), Ln = Eu	(II), Ln = Y
Ln1—O1	2.416 (3)	2.3677 (13)
Ln1—O2	2.577 (3)	2.4856 (13)
Ln1—O3	2.482 (2)	2.4125 (13)
Ln1—O4	2.566 (3)	2.5906 (13)
Ln1—O4ⁱ	2.337 (3)	2.2874 (13)
Ln1—O5	2.262 (3)	2.2894 (13)
Ln1—O6ⁱ	2.432 (3)	2.3000 (13)
Ln1—O7	2.567 (3)	2.5199 (13)
Ln1—O8	2.517 (3)	2.4967 (14)

Symmetry code: (i) -x, -y, -z+1 for (I), and -x, -y+1, -z for (II).

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Di- and tri­phenyl­acetate complexes of yttrium and europium

Supporting information

Di- and triphenylacetate complexes of yttrium and europium