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A. M. Banaru
Structure and crystal chemistry analysis of (4E)- and
(4Z)-6,6',7,7'-tetrahydro-5H,5'H-4,4'-bi-1-benzothiophene
Abstract
By means of X-ray crystallography the structures of (4E)-6,6',7,7'-tetrahydro-5H,5'H-4,4'-bi-1-benzothiophene
and (4Z)-6,6',7,7'-tetrahydro-5H,5'H-4,4'-bi-1-benzothiophene were
determined. For each compound the calculation of intermolecular interaction
energy was performed. The total energies of crystal, as well as the packing
indices, prove to be similar. The perspectives of pseudosymmetry effects were
disclosed.
Copyright (C) Chemistry Dept., Moscow State University, 2002
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