Steric and electronic structure of complexes of pyrylium and thiopyrylium cations with borabenzene anion View Full Text


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Article Info

DATE

2008-07

AUTHORS

M. K. Gridin, A. A. Milov, A. G. Starikov, R. M. Minyaev

ABSTRACT

The coordination of pyrylium and thiopyrylium cations with borabenzene was studied by DFT [B3LYP/6-311++G(d,p)] calculations. The structures of charge-transfer molecular complexes formed by the aromatic ions were predicted. The stabilization is due both to electron density transfer and to covalent bonding.

PAGES

1354

Identifiers

URI

http://scigraph.springernature.com/pub.10.1134/s1070363208070128

DOI

http://dx.doi.org/10.1134/s1070363208070128

DIMENSIONS

https://app.dimensions.ai/details/publication/pub.1049877260


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