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Shape and Spin State in Four-Coordinate Transition-Metal Complexes: The Case of the d6 Configuration

✍ Scribed by Jordi Cirera; Eliseo Ruiz; Santiago Alvarez

Publisher: John Wiley and Sons
Year: 2006
Tongue: English
Weight: 139 KB
Volume: 12
Category: Article
ISSN: 0947-6539
DOI: 10.1002/chem.200501516

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✦ Synopsis

Abstract

Generalized polyhedral interconversion coordinates are defined within the framework of Avnir's continuous shape measures. The application of such interconversion coordinates to the study of the potential energy surfaces that define the stereochemical choice in four‐coordinate transition metal complexes with different spin states is presented, and the correlation between potential energy curves and distribution of experimental structures along the tetrahedron to square interconversion path is shown for the case of the d^6^ transition‐metal complexes.

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