H2C2S
Ethenthione, thioketene
Species tag 058501
Version2*
Date of EntryOct. 2023
ContributorH. S. P. Müller

The line list was extended with respect to the first entry of June 2002 as descibed in
(1) H. S. P. Müller, A. Maeda, F. Lewen, S. Schlemmer, I. R. Medvedev, and E. Herbst, 2024, Mol. Phys. 122, Art. No. e2262057.
Extensive transition frequencies from the upper millimeter to the lower submillimeter region were taken from that work. Further, mostly millimeter data are from
(2) M. Winnewisser and E. Schäfer, 1980, Z. Naturforsch. 35a, 483.
J = 3 – 2 transitions are from
(3) K. Georgiou, H. W. Kroto, and B. M. Landsberg, 1979, J. Mol. Spectrosc. 77, 365.
Ka = 1 Q-branch transitions were taken from
(4) B. Bak, O. J. Nielsen, H. Svanholt, A. Holm, N. H. Toubro, A. Krantz, and J. Laureni, 1979, Acta Chem. Scand. A 33, 161.
Some higher order centrifugal distortion constants were kept fixed to values from
(5) D. McNaughton, E. G. Robertson, and L. D. Hatherley, 1996, J. Mol. Spectrosc. 175, 377.
Even though Ka = 7 lines are in the fit, their calculated positions at higher J should be viewed with some caution because of probable interaction with Ka = 4 of v9 = 1. Transitions with even higher values of Ka are probably unreliable. Moreover, calculations above 800 GHz should also be viewed with some caution.
At low temperatures, it may be necessary to discern between ortho-H2C2S and para-H2C2S. The ortho states are described by Ka odd, the para states by Ka even. The nuclear spin-weights are 3 and 1 for ortho-H2C2S and para-H2C2S, respectively. The JKaKc = 111 level is the lowest ortho level. It is 9.7413 cm–1 above ground.
The experimental dipole moment is from (2).

Lines Listed1567
Frequency / GHz< 1000
Max. J90
log STR0-11.0
log STR1-5.5
Isotope Corr. 
Egy / (cm–1)0.0
 µa / D1.01
 µb / D 
 µc / D 
 A / MHz286520
 B / MHz5659.476
 C / MHz5544.513
 Q(300.0)18523.3667
 Q(225.0)12025.6832
 Q(150.0)6543.6152
 Q(75.00)2313.6129
 Q(37.50)817.7480
 Q(18.75)280.0805
 Q(9.375)84.1360
 Q(5.000)26.1956
 Q(2.725)10.8797
detected in ISM/CSMyes


Database maintained by Holger S. P. Müller and Sven Thorwirth, programming by D. Roth and F. Schlöder