Subramanian, G. ; Jemmis, Eluvathingal D. (1999) Structure and stabilities of the isomers of SiB2H4 Chemical Physics Letters, 200 (6). pp. 567-572. ISSN 0009-2614
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Official URL: http://linkinghub.elsevier.com/retrieve/pii/000926...
Related URL: http://dx.doi.org/10.1016/0009-2614(92)80092-P
Abstract
Ab initio quantum-mechanical methods at the HF/6-31G∗, MP2/6-31G∗ and MP2/6-31G∗ levels are used to study the relative stabilities of the isomers of SiB2H4. Isomers obtained using the analogy between trivalent boron and divalent silicon are calculated to be more stable compared to isomers where carbon is replaced by the isovalent silicon. 2π aromaticity and the preference of silicon for lower valency control the relative stabilities of SiB2H4 isomers.
| Item Type: | Article |
|---|---|
| Source: | Copyright of this article belongs to Elsevier Science. |
| ID Code: | 13480 |
| Deposited On: | 12 Nov 2010 15:29 |
| Last Modified: | 04 Jun 2011 06:10 |
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