The distortivity of π-electrons in conjugated boron rings

Henry S. Rzepa

doi:10.1039/B911817A

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Physical Chemistry Chemical Physics

Issue 43, 2009

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The distortivity of π-electrons in conjugated boron rings

Henry S. Rzepa

Phys. Chem. Chem. Phys., 2009, 11, 10042-10046

DOI: 10.1039/B911817A
Received 16 Jun 2009, Accepted 17 Jul 2009
First published on the web 08 Sep 2009

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Abstract
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DFT calculations indicate that π-distortivity in boron rings as manifested via the Kekuléb_2u stretching mode is greatly reduced compared to carbocyclic annulenes.

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Physical Chemistry Chemical Physics

The distortivity of π-electrons in conjugated boron rings

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