NC6S
Cyanopentatrienthionyl, X 2Πr
Species tag 118501
Version1*
Date of EntryNov. 2024
ContributorH. S. P. Müller

The measurements of the lower spin component were taken from
(1) M. C. McCarthy, A. L. Cooksy, S. Mohamed, V. D. Gordon, and P. Thaddeus, 2003, Astrophys. J. Suppl. Ser. 144, 287.
The unresolved HFS doublets were treated with 2 kHz uncertainties instead of the reported 5. The calculation should be viewed with caution above 58 GHz. In addition, the hyperfine structure splitting should be viewed with some caution below 7 GHz.
The partition function takes into account the higher spin component as far as possible at present. It is essentially converged at 225 K. The slight incompleteness at higher T has negligible effect on the calculated intensities.
The dipole moment is from a quantum chemical calculation in (1).

Lines Listed1066
Frequency / GHz< 120
Max. J152
log STR0-12.0
log STR1-6.0
Isotope Corr. 
Egy / (cm–1)0.0
 µa / D3.63
 µb / D 
 µc / D 
 A / MHz 
 B / MHz395.551
 C / MHz 
 Q(300.0)171530.4791
 Q(225.0)124713.8274
 Q(150.0)78425.9339
 Q(75.00)33850.3519
 Q(37.50)14027.1595
 Q(18.75)6130.8668
 Q(9.375)2972.1554
 Q(5.000)1585.6531
 Q(2.725)866.3919
detected in ISM/CSMno


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