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Experimental study of electron density distribution in crystals of antimony(V) dicarboxylate complexes

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Abstract

The molecular structure and charge density distribution in the crystals of triphenylantimony bis[(2E)-3-phenylprop-2-enoate] [Ph3Sb(O2CCH=CHPh)2] and triphenylantimony bis[(2E)-3-(3-nitrophenyl)prop-2-enoate] benzene solvate [Ph3Sb(O2CCH=CHC6H4NO2-m)2·C6H6] derived from the high-resolution single-crystal X-ray diffraction data at 100 K are reported together with DFT calculations of these molecules. The nature of the chemical bonds and delocalization of electron density in carboxylate ligands was investigated. The intramolecular Sb···O interactions as well as intermolecular π···π, H···π and O···π ones and their energy are discussed.

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Acknowledgments

This work was supported by fund competitive support students, postgraduate students and young scientific-teaching staff Lobachevsky Nizhny Novgorod State University and Russian Foundation for Basic Research (Project Nos. 13-03-00891, 14-03-31625). Also work was partly supported by the Grant (The agreement of August 27, 2013 No. 02.B.49.21.0003 between the Ministry of education and science of the Russian Federation and Lobachevsky State University of Nizhny Novgorod).

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The authors have declared no conflict of interest.

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Authors and Affiliations

  1. G. A. Razuvaev Institute of Organometallic Chemistry of Russian Academy of Sciences, Tropinina 49, 603950, Nizhny Novgorod, Russian Federation

    Georgy K. Fukin, Maxim A. Samsonov, Olga S. Kalistratova & Aleksey V. Gushchin

  2. Lobachevsky State University of Nizhny Novgorod, 23 Gagarin Av., 603950, Nizhny Novgorod, Russian Federation

    Georgy K. Fukin, Maxim A. Samsonov, Olga S. Kalistratova & Aleksey V. Gushchin

Authors
  1. Georgy K. Fukin
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  2. Maxim A. Samsonov
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  3. Olga S. Kalistratova
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  4. Aleksey V. Gushchin
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Corresponding author

Correspondence to Georgy K. Fukin.

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Dedicated to the memory of Prof. O.V. Shishkin.

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Fukin, G.K., Samsonov, M.A., Kalistratova, O.S. et al. Experimental study of electron density distribution in crystals of antimony(V) dicarboxylate complexes. Struct Chem 27, 357–365 (2016). https://doi.org/10.1007/s11224-015-0604-x

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  • DOI: https://doi.org/10.1007/s11224-015-0604-x

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