l-C4H2
Butatrienylidene, 1A1
Species tag 050503
Version2
Date of EntryMay 2002
ContributorH. S. P. Müller

The experimental data was reported by
(1) T. C. Killian, J. M. Vrtilek, C. A. Gottlieb, E. W. Gottlieb, and P. Thaddeus 1990, Astrophys. J. 365, L89 and
(2) M. J. Travers, W. Chen, S. E. Novick, J. M. Vrtilek, C. A. Gottlieb, and P. Thaddeus 1996, J. Mol. Spectrosc. 180, 75.
There are three Ka = 4 transitions which afford the inclusion of three parameters to obtain a reduced standard deviation of the fit comparable to the fit without these lines. It is conceivable that the assignments are correct, but the poor reproduction in the fit may be due to Coriolis interaction of the ground vibrational state with the lowest bending mode. Therefore, the Ka = 4 transitions have been omitted from the fit. Consequently, predictions for these lines as well as higher Ka lines are unreliable and have been omitted.
The dipole moment is from a quantum chemical calculation.
At low temperatures, it may be necessary to discern between ortho-l-C4H2 and para-l-C4H2. The ortho states are described by Ka odd, the para states by Ka even. The nuclear spin-weights are 3 and 1 for ortho-l-C4H2 and para-l-C4H2, respectively. The JKaKc = 111 is the lowest ortho state. It is 9.6947 cm–1 above ground.

Lines Listed581
Frequency / GHz< 806
Max. J90
log STR0-7.0
log STR1-3.5
Isotope Corr.0.0
Egy / (cm-1)0.0
 µa / D4.1
 µb / D 
 µc / D 
 A / MHz286234
 B / MHz4503.31
 C / MHz4428.61
 Q(300.0)23244.4913
 Q(225.0)15090.1929
 Q(150.0)8210.7728
 Q(75.00)2902.7544
 Q(37.50)1025.7567
 Q(18.75)351.1983
 Q(9.375)105.4252
detected in ISM/CSMyes


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