ANALYSIS OF THE $\nu_{3}$ INFRARED FUNDAMENTAL BAND OF $H_{2}O^{+} (X ^{2}B_{1}$)

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1986

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Ohio State University

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The H2O+ optical spectrum was detected first in the laboratory by Lew1 and later in the tail of comet Kohoutec2. We have previously reported the observation by difference freqnency spectrometer of the vibration-rotation infrared spectrum of H2O+ in the region 3100−3400cm−1 using an A.C. glow discharge through He, H2 and O2 (100:1:1). The observed lines were assigned to the ν3 vibration-rotation band of that molecular ion. The ν1 band was not observable unlike the case of isoelectronic NH2 radical for which the ν1 transitions were reported to be much stronger than the ν3 transitions. The ground state molecular constants of Lew have been improved by including ground state combination differences from our data in the fit. A Watson reduced asymmetric rotor Hamiltonian, including the spin rotation interaction was used. The Coriolis interaction between the ν1 and ν3 vibrations has been included in the Hamiltonian to determine the excited state molecular constants for the first time.

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1 H. Lew, I. Heiber, J. Chem. Phys., 58, 1246 (1972) 2 P. A. Wehinger, S. Wyckoff, G. H., Herbig. G. Herzberg, H. Lew, Ap. J. ,190, L43 (1974) Address of Dinelli, Crofton and Oka: Department of Chemistry and Department of Astronomy and Astrophysics, The University of Chicago, Chicago, Illinois 60637 Permanent address of Dinelli: Istituto di Spettroscopia Molecolare del C.N.R., Bologna, Italy


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