HC3HCN
1-Cyanopropargyl
Species tag 064527
Version1*
Date of EntryDec. 2021
ContributorH. S. P. Müller

The data were given in
(1) C. Cabezas, M. Nakajima, C. H. Chang, M. Agúndez, Y. Endo, and J. Cernicharo, 2022, Astron. Astrophys. 657, Art. No. A24.
We point out that no decision on the reduction was made and that the S reduction should be preferred. Please note that for a small number of transitions some of the intermediate spin quanta are different from those in (1); this may be a consequence of subtle differences in the assignment procedure in the respective fitting programs. These transitions are labeled at the end of the lines in the line file.
The data set is limited in terms of quantum number coverage. Therefore, transitions were truncated at 115 GHz and at F = 20. Ka was limited to 1 for b-type transitions and to 2 for a-type transitions. Nevertheless, the calculations should be sufficiently accurate and extensive for searches in cold sources. Transition frequencies with calculated uncertainties exceeding 0.1 MHz or with Ka = 2 should be viewed with great caution.
The dipole moment is from a coupled cluster quantum-chemical calculation from (1).

Lines Listed4481
Frequency / GHz< 115
Max. J20
log STR0-12.0
log STR1-6.0
Isotope Corr. 
Egy / (cm–1)0.0
 µa / D3.70
 µb / D1.77
 µc / D 
 A / MHz29173.01
 B / MHz2807.945
 C / MHz2256.929
 Q(300.0)1449294.4491
 Q(225.0)941953.4509
 Q(150.0)513092.1555
 Q(75.00)181565.1853
 Q(37.50)64246.8728
 Q(18.75)22742.2909
 Q(9.375)8058.2998
 Q(5.000)3150.4428
 Q(2.725)1276.0666
detected in ISM/CSMno


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