High resolution FTIR spectroscopy of sulfur dioxide in the 1550-1950 cm-1 region: First analysis of the ν1 + ν2/ν2 + ν3 bands of 32S16O18O and experimental line intensities of ro-vibrational transitions in the ν1 + ν2/ν2 + ν3 bands of 32S16O2, 34S16O2, 32S18O2 and 32S16O18O

被引:12
|
作者
Ulenikov, O. N. [1 ]
Bekhtereva, E. S. [1 ]
Gromova, O. V. [1 ]
Horneman, V. -M. [2 ]
Sydow, C. [3 ]
Bauerecker, S. [3 ]
机构
[1] Natl Res Tomsk Polytech Univ, Inst Phys & Technol, Tomsk 634050, Russia
[2] Univ Oulu, Dept Phys, POB 3000, FIN-90014 Oulu, Finland
[3] Tech Univ Carolo Wilhelmina Braunschweig, Inst Phys & Theoret Chem, D-38106 Braunschweig, Germany
关键词
The nu(1) + nu(2)/nu(2) + nu(3) interacting states of sulfur dioxide; high resolution spectrum of sulfur dioxide species; line positions; intensities; INTERACTING VIBRATIONAL BANDS; FOURIER-TRANSFORM SPECTRUM; ISOTOPE SUBSTITUTION; POLYATOMIC-MOLECULES; ROTATIONAL STRUCTURE; ABSORPTION-BANDS; D2O MOLECULE; WATER-VAPOR; SO2; (SOO)-S-32-O-16-O-18;
D O I
10.1016/j.jqsrt.2017.02.005
中图分类号
O43 [光学];
学科分类号
070207 ; 0803 ;
摘要
The high resolution infrared spectra of the (SOO)-S-32-O-16-O-18 molecule were recorded for the first time with a Bruker IFS 120 HR Fourier transform interferometer and analysed in the region of 1550-1950 cm(-1) where the bands nu(1)+nu(2) and nu(2)+nu(3) are located. About 1050 and 1570 transitions were assigned in the experimental spectra with the maximum values of quantum numbers J(max.)/K-a(max.) equal to 64/16 and 58/19 to the bands nu(1)+nu(2) and nu(2)+nu(3), respectively. The subsequent weighted fit of experimentally assigned transitions was made with the Hamiltonian model which takes into account the resonance interactions between the studied vibrational states. As the result, a set of 16 fitted parameters was obtained which reproduces the initial 1442 ro-vibrational energy values obtained from the assigned transitions with the d(rms)=3.7x10(-4) cm(-1). An analysis of more than 4050 experimental ro-vibrational line intensities of the nu(1)+nu(2) and nu(2)+nu(3) bands of (SO2)-S-32-O-16 was made, and a set of 7 effective dipole moment parameters was obtained which reproduce the initial experimental line intensities with the d(rms)=6.9%. Values of these parameters, being re-calculated to the values of corresponding parameters of the (SO2)-S-34-O-16, (SO2)-S-32-O-18 and (SOO)-S-32-O-16-O-18 species were used for calculation of line intensities in the nu(1)+nu(2) and nu(2)+nu(3) bands of these three isotopologues. A list of transitions with their line intensities in the region of 1550-1950 cm(-1) for the four mentioned species is generated. (C) 2017 Elsevier Ltd. All rights reserved.
引用
收藏
页码:377 / 391
页数:15
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