SIMULTANEOUS ANALYSIS OF THE $\nu_{2}, \nu_{3}, \nu_{5}$ AND $\nu_{6}$ BANDS OF $CD_{3}F$

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1984

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Ohio State University

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The infrared spectrum of CD3F from 800 to 1220cm−1 measured with resolution of about 0.0045cm−1 has been analyzed using a model which treats the four fundamentals ν2(A1),ν3(A1),ν5(E) and ν6(E) simultaneously. 62 parameters were refined freely in a least squares fit of microwave data and over 4200 upper state energy levels with J≤40 obtained from the infrared spectrum. The root mean square deviations of the infrared and microwave data were 0.706×10−3cm−1 and 0.809×10−5cm−1 respectively. Practically all strong and medium strong, and even the great majority of the weak transitions have been assigned in the infrared spectrum. Due to strong Coriolis, α,r and higher order resonances, many normally ``forbidden'' infrared transitions have been observed which allows to determine the ground state constants A0 and DK0 with high accuracy. The energy levels in many of the observed submillimeter wave laser lines of CD3F can now be identified.

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Author Institution: Department of Chemistry, Helsinki University of Technology

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