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Crystal and Molecular Structures of Methylcytisine Nitro-Derivatives

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Pharmaceutical Chemistry Journal Aims and scope

Crystal structures of the two isomers N-methyl-11-nitro- and N-methyl-9-nitrocytisine (I and II) were investigated in detail using a combination of x-ray crystal structure analysis and quantum-chemical calculations. The unit cells of both isomers contained two symmetrically independent molecules. This fact was explained and reasons for the very substantial differences in the densities and melting points of crystals of the isomers were discussed.

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Acknowledgments

The work was supported financially by the Russian Foundation for Basic Research (Project RFBR No. 15-03-06931).

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Authors and Affiliations

  1. A. N. Nesmeyanov Institute of Organoelement Compounds, Russian Academy of Sciences, 28 Vavilova St., V-334, GSP-1, Moscow, 119991, Russia

    A. F. Smol’yakov, V. A. Karnoukhova & S. V. Osintseva

  2. Bashkir State University, Ufa, Bashkortostan, Russia

    P. R. Petrova

  3. Institute of Organic Chemistry, Ufa Scientific Center, Russian Academy of Sciences, Ufa, Bashkortostan, Russia

    A. V. Koval’skaya & I. P. Tsypysheva

Authors
  1. A. F. Smol’yakov
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  2. V. A. Karnoukhova
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  3. S. V. Osintseva
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  4. P. R. Petrova
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  5. A. V. Koval’skaya
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  6. I. P. Tsypysheva
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Correspondence to A. F. Smol’yakov.

Additional information

Translated from Khimiko-Farmatsevticheskii Zhurnal, Vol. 50, No. 12, pp. 55 – 60, December, 2016.

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Smol’yakov, A.F., Karnoukhova, V.A., Osintseva, S.V. et al. Crystal and Molecular Structures of Methylcytisine Nitro-Derivatives. Pharm Chem J 50, 826–832 (2017). https://doi.org/10.1007/s11094-017-1541-3

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  • DOI: https://doi.org/10.1007/s11094-017-1541-3

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