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Microwave spectra of the (HF)2, (DF)2, HFDF,and DFHF hydrogen-bonded complexes
Institution:1. Institute of Chemistry FEB RAS, 159, Pr. Stoletya Vladivostoka, Vladivostok 690022, Russia;2. Institute of Solid State Chemistry and Mechanochemistry, SB RAS, 18, Kutateladze Str., Novosibirsk 630128, Russia;1. Institute of Inorganic Chemistry, Slovak Academy of Sciences, Dúbravská cesta 9, SK-845 36 Bratislava, Slovakia;2. Conditions Extremes et Materiaux: Haute Temperature et Irradiation, 1D avenue de la Recherche Scientifique CS 90055, 45071 Orleans Cedex 2, France
Abstract:The microwave spectra of the tunneling-rotation bands of the hydrogen-bonded complexes (HF)2 and (DF)2 have been measured in the 50- to 126-GHz region. In addition, the pure rotation spectra of both the HFDF and DFHF molecules have been obtained. Transitions with K = 0 through K = 2 have been observed for all isotopic species. The hydrogen fluoride dimer is a very nonrigid molecular species. In order to fit the observed transitions adequately, empirical expressions for the energy levels were used, and each K subband was separately fitted. Constants obtained from a Padé approximant fitting of the microwave data of (HF)2 together with infrared ground state combination differences are given.
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