High-resolution FTIR study of thiocarbonyl difluoride SCF2 -: Analysis of the ν2, ν3, ν5, and ν6 bands

被引:4
|
作者
Burger, H [1 ]
Jerzembeck, W [1 ]
机构
[1] Berg Univ Gesamthsch Wuppertal, D-42097 Wuppertal, Germany
关键词
D O I
10.1006/jmsp.1998.7528
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
High-resolution (similar to 3 x 10(-3) cm(-1)) FTIR spectra of the planar SCF2 molecule have been recorded in the range of the four lowest-lying fundamentals nu(2) (789.535 cm(-1)), nu(3) (526.697 cn(-1)), nu(5) (419.546 cm(-1)), and v(6) (623.187 cm(-1)). For each band 4500-7500 transitions have been assigned and fitted to a standard Watson-type Hamiltonian up to quartic terms, sigma(Fit) similar to 3.5 x 10(-4) cm(-1). No indication of rovibrational perturbations was found, excited state rotational and centrifugal distortion constants being close to their ground state values. Ground state parameters previously determined from microwave spectra were, in part, improved by a merge of the appropriately weighted microwave data and similar to 10 000 ground state combination differences that were obtained from the nu(4) band and spanning J and K-a values of 88 and 49, respectively. (C) 1998 Academic Press.
引用
收藏
页码:209 / 214
页数:6
相关论文
共 50 条
  • [1] Rovibrational analysis of ν2 and 2ν5 bands of DCOOH by high resolution FTIR spectroscopy
    Tan, TL
    Goh, KL
    Ong, PP
    Teo, HH
    JOURNAL OF MOLECULAR SPECTROSCOPY, 1999, 198 (02) : 387 - 392
  • [2] High-resolution IR spectrum of SCF2 from 1000 to 1400 cm-1:: The ν1/ν3+2ν5/ν2+ν3 and ν4/ν2+ν5 interacting states
    Flaud, JM
    Jerzembeck, W
    Bürger, H
    JOURNAL OF MOLECULAR SPECTROSCOPY, 1999, 197 (02) : 297 - 306
  • [3] High-resolution FTIR spectroscopy of CH2D35Cl:: rovibrational analysis of the ν3, ν9 fundamentals and the 2ν6-ν6, ν5+ν6-ν5 hot bands
    Baldacci, A.
    Visinoni, R.
    Giorgianni, S.
    Nivellini, G.
    MOLECULAR PHYSICS, 2008, 106 (9-10) : 1233 - 1240
  • [4] HIGH-RESOLUTION FTIR SPECTRUM OF THE NU(5) AND 2-NU(9) BANDS OF HNO3
    TAN, TL
    LOOI, EC
    LUA, KT
    SPECTROCHIMICA ACTA PART A-MOLECULAR AND BIOMOLECULAR SPECTROSCOPY, 1992, 48 (07): : 975 - 981
  • [5] High-resolution stimulated Raman spectroscopy and analysis of the ν2, ν5 and 2ν6 bands of 34SF6
    Boudon, V.
    Domenech, J. L.
    Ramos, A.
    Bermejo, D.
    Willner, H.
    MOLECULAR PHYSICS, 2006, 104 (16-17) : 2653 - 2661
  • [6] Ab initio study of scandium fluoride molecules: ScF, ScF2, AND ScF3
    V. G. Solomonik
    A. A. Mukhanov
    Journal of Structural Chemistry, 2012, 53 : 28 - 34
  • [7] HIGH-RESOLUTION FTIR STUDY OF THE NU-1+NU-3 AND 2-NU-3+NU-5+NU-6 ROVIBRATIONAL BANDS OF METHYL BROMIDE
    OUAHMAN, M
    BENSARIZIZI, N
    GUELACHVILI, G
    ALAMICHEL, C
    JOURNAL OF MOLECULAR SPECTROSCOPY, 1988, 129 (02) : 276 - 283
  • [8] Ab initio study of scandium fluoride molecules: ScF, ScF2, AND ScF3
    Solomonik, V. G.
    Mukhanov, A. A.
    JOURNAL OF STRUCTURAL CHEMISTRY, 2012, 53 (01) : 28 - 34
  • [9] High-resolution infrared spectra and simultaneous rovibrational analysis of the ν2, ν3, ν5, and ν6 bands of H3SiF
    Papousek, D
    Bürger, H
    Rahner, A
    Schulz, P
    Hollenstein, H
    Quack, M
    JOURNAL OF MOLECULAR SPECTROSCOPY, 1999, 195 (02) : 263 - 280
  • [10] The ν2 + ν4 and 2ν2 + ν5 high-resolution infrared bands of FClO3
    Cane, Elisabetta
    Fusina, Luciano
    Tarroni, Riccardo
    Burczyk, Klaus
    MOLECULAR PHYSICS, 2011, 109 (17-18) : 2143 - 2152