High-resolution FTIR spectroscopy of HNSO -: Analysis of the highly perturbed v4, v6 and 2v5 bands

被引:7
|
作者
Puskar, Ljiljana [1 ]
Robertson, Evan G. [1 ]
McNaughton, Don [1 ]
机构
[1] Monash Univ, Sch Chem, Clayton, Vic 3800, Australia
基金
澳大利亚研究理事会;
关键词
thionylimide (HNSO); high-resolution IR spectroscopy; rovibrational analysis; spectral analysis by subtraction of simulated intensities (SASSI);
D O I
10.1016/j.jms.2006.10.001
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 report a rovibrational analysis of the v(4) and v(6) fundamentals and the 2v(5) overtone of HNSO from high-resolution Fourier transform infrared spectra. The v(6) band (out-of-plane bend) centred at 757.5 cm(-1) is c-type. The v(4) band (FINS bend) centred at 905.9 cm(-1) is predominantly a-type with a very weak b-type component (mu(2)(a)/mu(2)(b) = 12.4). Numerous global perturbations and localized avoided crossings affecting the v(4) = 1 rotational levels were successfully treated by inclusion of Fermi and c-axis Coriolis resonance terms between v(4) = 1 and v(5) = 2, and a b-axis Coriolis resonance term between v(4) = 1 and v(6) = 1. The latter term gives rise to an avoided crossing with an extraordinary vertical bar Delta K-a vertical bar = 5 selection rule. The Fermi resonance between v(4) = 1 and v(5) = 2 gives rise to strong mixing of their rotational wavefunctions in the vicinity of K-a = 18. The resultant borrowing of intensity made it possible for 2v(5) transitions in the range K-a = 16-19 to be assigned and included in a global rovibrational treatment of all three band systems. (c) 2006 Elsevier Inc. All rights reserved.
引用
收藏
页码:244 / 250
页数:7
相关论文
共 50 条
  • [21] LASER STARK SPECTROSCOPY OF FORMALDEHYDE-D2 - CORIOLIS COUPLED V4 AND V6 FUNDAMENTALS
    COFFEY, D
    YAMADA, C
    HIROTA, E
    JOURNAL OF MOLECULAR SPECTROSCOPY, 1977, 64 (01) : 98 - 108
  • [22] v4, v5, v6, v7: Nonlinear hydrodynamic response versus LHC data
    Yan, Li
    Ollitrault, Jean-Yves
    PHYSICS LETTERS B, 2015, 744 : 82 - 87
  • [23] High-resolution cw-cavity ring-down spectroscopy of allowed (v4 + v5)0 and forbidden (v4 + v5)2 bands of C2H2 using external-cavity quantum cascade laser
    Pal, Mithun
    Pradhan, Manik
    JOURNAL OF MOLECULAR SPECTROSCOPY, 2020, 370
  • [24] High resolution FTIR study of the v5 and v6 bands of CH2D35Cl:: analysis of resonances and determination of ground and upper state constants
    Baldacci, A
    Stoppa, P
    Charmet, AP
    Giorgianni, S
    Nivellini, G
    MOLECULAR PHYSICS, 2005, 103 (20) : 2803 - 2811
  • [25] High resolution FTIR spectrum of CH2 D37 Cl: v4 and v8 fundamental bands
    Stoppa, Paolo
    Charmet, Andrea Pietropolli
    Tamassia, Filippo
    Cane, Elisabetta
    Melosso, Mattia
    Achilli, Andre
    Dore, Luca
    Puzzarini, Cristina
    JOURNAL OF QUANTITATIVE SPECTROSCOPY & RADIATIVE TRANSFER, 2023, 309
  • [26] Evidence of vibrational-induced rotational axis switching for HD12C16O:: New high-resolution analysis of the v5 and v6 bands and first analysis of the v4 band (10-μm region)
    Perrin, A
    Flaud, JM
    Smirnov, M
    Lock, M
    JOURNAL OF MOLECULAR SPECTROSCOPY, 2000, 203 (01) : 175 - 187
  • [27] Rovibrational analysis of the v4 and v5+ v9 bands of CHCl2F
    Albert, S
    Albert, KK
    Quack, M
    JOURNAL OF MOLECULAR STRUCTURE, 2004, 695 : 385 - 394
  • [28] The analysis of the Coriolis interactions in the v10=1, v7=1 and v4=1 triad rovibrational states of 13C2D4 by high-resolution FTIR spectroscopy
    Ng, L. L.
    Tan, T. L.
    MOLECULAR PHYSICS, 2020, 118 (07)
  • [29] First high-resolution analysis of the v15, v12, v5, v10 and v2 bands of oxirane
    Flaud, J. -M.
    Lafferty, W. J.
    Tchana, F. Kwabia
    Perrin, A.
    Landsheere, X.
    JOURNAL OF MOLECULAR SPECTROSCOPY, 2012, 271 (01) : 38 - 43
  • [30] Millimeter-wave and high-resolution FTIR spectroscopy of SiH2F2:: the ground and v4=1 states
    D'Eu, JF
    Demaison, J
    Bürger, H
    JOURNAL OF MOLECULAR SPECTROSCOPY, 2003, 218 (01) : 12 - 21