Chirped-pulse Fourier-transform millimeter-wave rotational spectroscopy of furan in its v10 and v13 excited vibrational states
Abstract
Furan, a prototypical heteroaromatic cyclic ether, is an important molecule that has garnered attention from a wide range of fields, from food and health research to combustion and atmospheric chemistry. Chirped-pulse Fourier-transform rotational spectroscopy of jet-cooled furan in the W-band across three narrow regions 79.3-79.45 GHz, 88.6-88.8 GHz, and 97.95-98.15 GHz is reported here. A pyrolysis nozzle was used to efficiently populate vibrationally excited states of low-frequency modes. Apart from the v = 0 state, vibrationally excited v = 1 states of modes v11, v14, v10, and v13 were observed. Furan is a planar molecule and these observed excited state modes correspond to out-of-plane vibrations. The v = 0 state and the vibrationally excited v11 and v14 were previously recorded and fit by Barnum et al (T. J. Barnum, K. L. K. Lee, B. A. McGuire, ACS Earth Space Chem. 5 (2021), 2986-2994). Rotational transitions in the J"=5 to 9 rotational states were fit for the previously undetected v10 mode and experimental linelists for v = 1 states of modes v10 and v13 are provided, both of which are out-of-plane CH bending modes. Inertial defect was shown to be a useful quantity to extract structural information of vibrational modes of planar asymmetric tops. These rotational fits will assist astronomical searches for furan and its vibrational states.
- Publication:
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Journal of Molecular Spectroscopy
- Pub Date:
- July 2022
- DOI:
- Bibcode:
- 2022JMoSp.38811686M