Microwave spectrum of the CH3CCS radical in the E-2(3/2) electronic groundstate

Citation
H. Habara et S. Yamamoto, Microwave spectrum of the CH3CCS radical in the E-2(3/2) electronic groundstate, J CHEM PHYS, 115(10), 2001, pp. 4502-4507
Citations number
14
Categorie Soggetti
Physical Chemistry/Chemical Physics
Journal title
JOURNAL OF CHEMICAL PHYSICS
ISSN journal
00219606 → ACNP
Volume
115
Issue
10
Year of publication
2001
Pages
4502 - 4507
Database
ISI
SICI code
0021-9606(20010908)115:10<4502:MSOTCR>2.0.ZU;2-K
Abstract
The rotational spectrum of a symmetrical-top radical CH3CCS in the E-2(3/2) electronic ground state has been detected by microwave spectroscopy. The C H3CCS radical is produced by discharging a gaseous mixture of CH3CCH and CS 2, and 50 spectral lines with the K range from -4 to 6 are observed in the 132-261 GHz region with a source modulation millimeter-wave spectrometer. I n addition, 19 low-J lines with K=0 and 1 are measured in the 11-21 GHz reg ion with a Fourier transform microwave spectrometer. Ten molecular constant s including hyperfine interaction constants are determined accurately by a least-squares method. The obtained hyperfine constants are found to be abou t a half of those of a related radical, CH3S, indicating that the structure of CH3CCS would be expressed in a classical resonant form; H3C-C=C-(S) ove r dot <->H3C=(C) over dot =C=S. (C) 2001 American Institute of Physics.