ROTATIONAL SPECTRUM, MOLECULAR-CONSTANTS, AND DIPOLE-MOMENT OF THE SYN FORM OF VINYLPHOSPHINE

Citation
P. Drean et al., ROTATIONAL SPECTRUM, MOLECULAR-CONSTANTS, AND DIPOLE-MOMENT OF THE SYN FORM OF VINYLPHOSPHINE, Journal of molecular spectroscopy, 176(1), 1996, pp. 180-184
Citations number
11
Categorie Soggetti
Spectroscopy,"Physics, Atomic, Molecular & Chemical
ISSN journal
00222852
Volume
176
Issue
1
Year of publication
1996
Pages
180 - 184
Database
ISI
SICI code
0022-2852(1996)176:1<180:RSMADO>2.0.ZU;2-8
Abstract
The rotational spectrum of the syn conformer of vinylphosphine from 8 to 250 GHz has been measured. The assignment was based on nb initio ca lculations performed at the MP2 level using the 6-311G (2d, p) basis s et. Rotational and centrifugal distortion constants up to the sextic t erms were determined. The dipole moment was measured using the Stark e ffect. It is to be noted that the ab initio structure reproduces the e xperimental data satisfactorily. (C) 1996 Academic Press, Inc.