Giju, Kalathingal T. ; Phukan, Ashwini Kumar ; Jemmis, Eluvathingal D. (2003) Stabilization of tricoordinate pyramidal boron: theoretical studies on CBSiH5, BSi2H5, CBGeH5, and CBSnH5 Angewandte Chemie International Edition, 42 (5). pp. 539-542. ISSN 1433-7851
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Official URL: http://onlinelibrary.wiley.com/doi/10.1002/anie.20...
Related URL: http://dx.doi.org/10.1002/anie.200390155
Abstract
Discovery of new pyramids: Theoretical studies have characterized CBSiH5, BSi2H5, CBGeH5, and CBSnH5, all of which have a tricoordinate pyramidal boron atom as minima on their respective potential energy surfaces. The extent of pyramidalization, as well as the energy for inversion through the planar structure, is dependent on the substituents of the boron atom.
| Item Type: | Article |
|---|---|
| Source: | Copyright of this article belongs to John Wiley and Sons, Inc. |
| Keywords: | Boron; Computer Chemistry; Density Functional Calculations; Small Ring Systems |
| ID Code: | 13640 |
| Deposited On: | 12 Nov 2010 15:12 |
| Last Modified: | 04 Jun 2011 05:46 |
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