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Rotational spectroscopy of methyl mercaptan CH$_3$$^{32}$SH at millimeter and submillimeter wavelengths

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arxiv 1908.07790 v1 pith:DR4X2V3D submitted 2019-08-21 astro-ph.IM astro-ph.SRphysics.atm-clusphysics.chem-ph

classification astro-ph.IMastro-ph.SRphysics.atm-clusphysics.chem-ph
keywords wavedatameasurementsmercaptanmethylmillimeterspectrastates
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abstract

We present a new global study of the millimeter (mm) wave, submillimeter (sub-mm) wave, and terahertz (THz) spectra of the lowest three torsional states of methyl mercaptan (CH$_3$SH). New measurements have been carried out between 50 and 510 GHz using the Kharkiv mm wave and the Cologne sub-mm wave spectrometers whereas THz spectra records were used from our previous study. The new data, involving torsion-rotation transitions with $J$ up to 61 and $K_a$ up to 18, were combined with previously published measurements and fit using the rho-axis-method torsion-rotation Hamiltonian. The final fit used 124 parameters to give an overall weighted root-mean-square deviation of 0.72 for the dataset consisting of 6965 microwave (MW) and 16345 far-infrared line frequencies sampling transitions within and between the ground, first, and second excited torsional states. This investigation presents a two-fold expansion in the $J$ quantum numbers and a significant improvement in the fit quality, especially for the MW part of the data, thus allowing us to provide more reliable predictions to support astronomical observations.

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