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Abstract:
The v8 band of CF2 NH near 830 cm−1 has been measured with a resolution of 0.003 cm−1 and
rotationally analyzed. The band is unperturbed, and its rovibrational parameters are given up to fourth order. Theoretical harmonic and anharmonic force constants have been calculated at the
6-31 G ** SCF level, and all vibration-rotation interaction constants αi and anharmonicity constants xij are predicted. The theoretical results are compared with the available experimental data.