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Pure Rotational Spectroscopy of the CH 2 CN Radical Extended to the Sub-Millimeter Wave Spectral Region.

Authors :
Chitarra O
Pirali O
Spaniol JT
Hearne TS
Loison JC
Stanton JF
Martin-Drumel MA
Source :
The journal of physical chemistry. A [J Phys Chem A] 2022 Oct 20; Vol. 126 (41), pp. 7502-7513. Date of Electronic Publication: 2022 Oct 05.
Publication Year :
2022

Abstract

We present a thorough pure rotational investigation of the CH <subscript>2</subscript> CN radical in its ground vibrational state. Our measurements cover the millimeter and sub-millimeter wave spectral regions (79-860 GHz) using a W-band chirped-pulse instrument and a frequency multiplication chain-based spectrometer. The radical was produced in a flow cell at room temperature by H abstraction from acetonitrile using atomic fluorine. The newly recorded transitions of CH <subscript>2</subscript> CN (involving N ″ and K <subscript>a</subscript> ″ up to 42 and 8, respectively) were combined with the literature data, leading to a refinement of the spectroscopic parameters of the species using a Watson S-reduced Hamiltonian. In particular, the A rotational constant and K -dependent parameters are significantly better determined than in previous studies. The present model, which reproduces all experimental transitions to their experimental accuracy, allows for confident searches for the radical in cold to warm environments of the interstellar medium.

Details

Language :
English
ISSN :
1520-5215
Volume :
126
Issue :
41
Database :
MEDLINE
Journal :
The journal of physical chemistry. A
Publication Type :
Academic Journal
Accession number :
36198131
Full Text :
https://doi.org/10.1021/acs.jpca.2c04399