Issue 3, 2006
From the journal:

New Journal of Chemistry

Valence shell charge concentrations and the Dewar–Chatt–Duncanson bonding model†

Wolfgang Scherer,*a   Georg Eickerling,a   Dmitry Shorokhov,a   Emanuel Gullo,b   G. Sean McGradyc  and  Peter Sirschc  

* Corresponding authors

a Institut für Physik, Universität Augsburg, Universitätsstr. 1, Augsburg, Germany
E-mail: wolfgang.scherer@physik.uni-augsburg.de
Fax: +49-(0)821-598-3227
Tel: +49(0)821-598-3350

b Department of Chemistry, University of Bath, Claverton Down, Bath, UK

c Department of Chemistry, University of New Brunswick, Fredericton, NB, Canada

Abstract

Combined experimental and theoretical charge density studies of the complex [Ni(η2-C2H4)dbpe] (dbpe = But2PCH2CH2PBut2), 1, reveal how the location and magnitude of charge concentrations in the valence shell of the metal atom influence the σ- and π-components of the metal–olefin interaction.

Graphical abstract: Valence shell charge concentrations and the Dewar–Chatt–Duncanson bonding model

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Article information

DOI
https://doi.org/10.1039/B515171F
Article type
Letter
Submitted
26 Oct 2005
Accepted
06 Jan 2006
First published
03 Feb 2006

New J. Chem., 2006,30, 309-312

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Valence shell charge concentrations and the Dewar–Chatt–Duncanson bonding model

W. Scherer, G. Eickerling, D. Shorokhov, E. Gullo, G. S. McGrady and P. Sirsch, New J. Chem., 2006, 30, 309 DOI: 10.1039/B515171F

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