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Electron Density Distribution and Structural and Energy Aspects of the Phase Transition in the Crystals of the Triphenylantimony Dimethacrylate Complex

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Abstract

The electron density distribution in Ph3Sb(O2CC(Me)=CH2)2 ⋅ C6H6 and structural and energy aspects of the phase transition in the crystals of this compound were investigated using a series of common (Ib−Ie) and high-precision (Ia) X-ray diffraction experiments. A considerable difference between the root-mean-square atomic displacements in two chemically equivalent methyl groups of the methacrylate ligands was revealed. This difference was shown to be caused by considerable energy difference of the intra- and intermolecular contacts of the corresponding methyl groups.

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ACKNOWLEDGMENTS

This study was supported by the Russian Foundation for Basic Research (project no. 17-03-01257).

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Authors and Affiliations

  1. Razuvaev Institute of Organometallic Chemistry, Russian Academy of Sciences, 603950, Nizhny Novgorod, Russia

    G. K. Fukin, M. A. Samsonov, E. V. Baranov, A. V. Cherkasov, R. V. Rumyantsev & A. V. Arapova

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  1. G. K. Fukin
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  2. M. A. Samsonov
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  3. E. V. Baranov
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  4. A. V. Cherkasov
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  5. R. V. Rumyantsev
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  6. A. V. Arapova
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Correspondence to G. K. Fukin.

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Translated by Z. Svitanko

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Fukin, G.K., Samsonov, M.A., Baranov, E.V. et al. Electron Density Distribution and Structural and Energy Aspects of the Phase Transition in the Crystals of the Triphenylantimony Dimethacrylate Complex. Russ J Coord Chem 44, 626–634 (2018). https://doi.org/10.1134/S1070328418100020

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  • DOI: https://doi.org/10.1134/S1070328418100020

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