Absolute intensities in the nu(1), 2 nu(2), 2 nu(3)+nu(4) band system of carbonyl fluoride

被引:1
作者
Duxbury, G
McPhail, MJW
McPheat, R
机构
[1] Department of Physics and Applied Physics, University of Strathclyde, John Anderson Building, Glasgow, G4 0NG
来源
JOURNAL OF THE CHEMICAL SOCIETY-FARADAY TRANSACTIONS | 1997年 / 93卷 / 16期
关键词
D O I
10.1039/a701474k
中图分类号
O64 [物理化学(理论化学)、化学物理学];
学科分类号
070304 ; 081704 ;
摘要
The IR spectrum of carbonyl fluoride, COF2, has been measured in the region 1880-1980 cm(-1) using a Bomem Fourier transform spectrometer under 0.005 cm(-1) resolution at a gas pressure of 3.2 Torr, 10 cm pathlength and at room-and stratospheric (ca. 200 K) temperatures. In this region the v(1) band at 1945 cm(-1) dominates the spectrum and is in Fermi resonance with the weaker 2v(2) band at 1914 cm(-1), and in B-type Coriolis resonance with the 2v(3) + v(4) band at 1936 cm(-1). The absorption coefficients of this band system have been determined from the experimental spectra and the integrated intensity in this region is found to be 3.07 x 10(-17) cm molecule(-1) at room temperature and 3.26 x 10(-17) cm molecule(-1) at ca. 200 K. Using calculated spectra the integrated intensities were predicted to be 2.90 x 10(-17) cm molecule(-1) and 3.01 x 10(-17) cm molecule(-1), respectively using transition dipole moments of 0.1592 D for v(1) and 0.1097 D for 2v(2).dagger The small discrepancy in integrated intensity can be accounted for from thermally populated states, whose contribution was not calculated.
引用
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页码:2731 / 2734
页数:4
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