Systematic analysis of the Fourier transform spectrum of 13CH3OH between 400 and 950 cm-1

被引:5
|
作者
Moraes, JCS
Moruzzi, G
Strumia, F
Winnewisser, BP
机构
[1] Univ Pisa, Dipartimento Fis Enrico Fermi, I-56127 Pisa, Italy
[2] UNESP, Dept Quim & Fis, BR-15385000 Ilha Solteira, SP, Brazil
[3] Univ Giessen, Inst Chem Phys, D-35392 Giessen, Germany
关键词
Fourier transform spectra; (CH3OH)-C-13 assignment; far-infrared spectra; methanol; torsional excitation;
D O I
10.1016/j.jms.2005.08.002
中图分类号
O64 [物理化学(理论化学)、化学物理学]; O56 [分子物理学、原子物理学];
学科分类号
070203 ; 070304 ; 081704 ; 1406 ;
摘要
We have investigated a high-resolution Fourier transform (FT) absorption spectrum of the (CH3OH)-C-13 isotopomer of methanol from 400 to 950 cm(-1) with the "Ritz" program. We present the assignments of 7160 transitions, 3021 of which belong to Asymmetry, and 4139 to E-symmetry. These transitions occur between states labeled by K quantum numbers up to 14, and by torsional quantum numbers n up to 4. The "Ritz" program evaluated the energies of the 4684 involved levels with an accuracy of the order of 10(-4) cm(-1). All of the assigned lines correspond to transitions involving torsionally excited levels within the ground small-amplitude vibrational state. (c) 2005 Elsevier Inc. All rights reserved.
引用
收藏
页码:25 / 33
页数:9
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