Overtone spectrum and the Fermi resonance of the SiH chromophore in SiHCl3

Citation
Y. Ding et al., Overtone spectrum and the Fermi resonance of the SiH chromophore in SiHCl3, MOLEC PHYS, 99(19), 2001, pp. 1669-1678
Citations number
43
Categorie Soggetti
Physical Chemistry/Chemical Physics
Journal title
MOLECULAR PHYSICS
ISSN journal
00268976 → ACNP
Volume
99
Issue
19
Year of publication
2001
Pages
1669 - 1678
Database
ISI
SICI code
0026-8976(200110)99:19<1669:OSATFR>2.0.ZU;2-K
Abstract
The Fourier transform and Fourier transform intracavity laser absorption sp ectra of the gas phase SiHCl3 molecule were recorded from 1000 cm(-1) up to 13 000 cm(-1). The normal mode analysis is carried out to rt the observed band centres. The reduced Hamiltonian models in terms of normal and curvili near internal coordinates are used to study the Fermi resonance between the SiH stretching and bending modes and analyse the observed band centres ass ociated with the SiH chromophore. The resonance in the SiH chromophore is f ound not to be important due to the cancellation of the contributions from the kinetic and the potential coupling terms. Off-diagonal anharmonic const ants between the SiH stretching and bending manifold and the molecular fram e have been determined. The SiH chromophore vibrational intensities are als o reported.