The Rotational Spectrum of the Ground State of Methylamine
Vadim V. Ilyushin, E A. Alekseev, S F. Dyubkoa, R A. Motiyenkoa, Jon T. Hougen
Recent progress is reported in measuring, assigning and fitting the rotational spectrum of the ground vibrational state of methylamine, CH3NH2, a spectrum complicated both by internal rotation of the methyl top and by inversion of the amino group. New measurements of 513 rotational transitions with J up to 30 and K up to 9 were carried out between 49 and 326 GHz using the millimeter-wave spectrometer in Kharkov. After removing the observed quadrupole hyperfine splittings, these new data along with previously published measurements were fitted to a group-theoretical high-barrier tunneling Hamiltonian from the literature, using 57 parameters to give an overall weighted standard deviation of 0.79 for 850 far-infrared and 668 microwave transitions in the ground state. The root-mean-square deviation of 0.016 MHz obtained for 366 millimeter-wave transitions measured with 0.020 MHz accuracy represents an approximately 30-fold improvement in fitting accuracy over past attempts.
Journal of Molecular Spectroscopy
amino group inversion motion, high-barrier tunneling formalism, least-squares fit, methyl group internal rotation, methylamine, microwave spectrum
, Alekseev, E.
, Dyubkoa, S.
, Motiyenkoa, R.
and Hougen, J.
The Rotational Spectrum of the Ground State of Methylamine, Journal of Molecular Spectroscopy
(Accessed June 6, 2023)