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Estimates of the ab initio limit for sulfur-Pi interactions: The H(sub 2)S-benzene dimer
- Source :
- Journal of Physical Chemistry A. Jan 13, 2005, Vol. 109 Issue 1, p191, 5 p.
- Publication Year :
- 2005
-
Abstract
- A study is conducted to examine H(sub 2)S-benzene dimer as the simplest model of sulfur-Pi interactions. Analysis of the interaction using symmetry-adapted perturbation theory, along with potential energy curve for rotation of the H(sub 2)S unit relative to the benzene ring, suggests that the sulfur-Pi interaction is an electrostatic attraction between the partial positive hydrogen in H(sub 2)S and the negatively charged Pi electrons of benzene.
Details
- Language :
- English
- ISSN :
- 10895639
- Volume :
- 109
- Issue :
- 1
- Database :
- Gale General OneFile
- Journal :
- Journal of Physical Chemistry A
- Publication Type :
- Academic Journal
- Accession number :
- edsgcl.132455182