Singh, U Chandra and Basu, PK and Rao, CNR (1982) Lone-pair interactionsnext term in previous termmolecules. In: Journal of Molecular Structure (Theochem), 87 (2). pp. 125-132.
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Abstract
Theoretically calculated previous termlone-pairnext term splittings in H2O2, H2S2, N2H4, P2H4, glyoxal and dithioglyoxal have been compared with experimental values. Potential functions for rotation and the effect of geometry relaxation on rotomer energies have also been examined.
| Item Type: | Journal Article |
|---|---|
| Publication: | Journal of Molecular Structure (Theochem) |
| Publisher: | Elsevier Science |
| Additional Information: | Copyright of this article belongs to Elsevier Science. |
| Department/Centre: | Division of Chemical Sciences > Solid State & Structural Chemistry Unit |
| Date Deposited: | 28 Aug 2009 15:44 |
| Last Modified: | 19 Sep 2010 05:41 |
| URI: | http://eprints.iisc.ac.in/id/eprint/22309 |
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