Article ID Journal Published Year Pages File Type
5415216 Journal of Molecular Spectroscopy 2010 7 Pages PDF
Abstract
Rotational level structure of 12 vibrational states of CH2DI with energies in the 1000-1800 cm−1 region has been retrieved from high resolution (0.001-0.003 cm−1) FTIR spectra. Eleven vibrational states, namely, 21, 3161(A′), 51(A′′), 3161(A′′), 62(A′), 51(A′), 61(A′) 61(A′′), 2131, 62(A′′), 3261(A′) and 3151(A′′) have been found to interact. A total of 27 919 transitions belonging to diverse fundamental, combination and hot bands were assigned and used in the combined nonlinear root mean square fit to give the band centers, rotational, centrifugal distortion and coupling parameters of the states under investigation. The RMS deviation of the fit has been demonstrated to be 0.000218 cm−1. The number of the coupling parameters required to reproduce the observed spectra with the experimental uncertainty appeared to be 46.
Related Topics
Physical Sciences and Engineering Chemistry Physical and Theoretical Chemistry
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