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Russian Journal of Coordination Chemistry

, Volume 44, Issue 10, pp 626–634 | Cite as

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

  • G. K. Fukin
  • M. A. Samsonov
  • E. V. Baranov
  • A. V. Cherkasov
  • R. V. Rumyantsev
  • A. V. Arapova
Article

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 (IbIe) 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.

Keywords:

triphenylantimony methacrylate complex high-precision X-ray diffraction phase transition Bader’s theory Atoms in Molecules root-mean-square atomic displacements 

Notes

ACKNOWLEDGMENTS

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

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Copyright information

© Pleiades Publishing, Ltd. 2018

Authors and Affiliations

  • G. K. Fukin
    • 1
  • M. A. Samsonov
    • 1
  • E. V. Baranov
    • 1
  • A. V. Cherkasov
    • 1
  • R. V. Rumyantsev
    • 1
  • A. V. Arapova
    • 1
  1. 1.Razuvaev Institute of Organometallic Chemistry, Russian Academy of SciencesNizhny NovgorodRussia

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