l-C4HD
Butatrienylidene, mono-deuterated species
Species tag 051521
Version1*
Date of EntryJune 2009
ContributorH. S. P. Müller

The experimental data was reported by
(1) E. Kim and S. Yamamoto, 2005, J. Mol. Spectrosc. 233, 93.
Because of the limited input data, predictions were limited to 300 GHz and Ka = 0. Several spectroscopic parameters have been estimated from ab initio calculations by
(2) H. S. P. Müller, 2009, unpublished.
It is advisable to view predictions even in the 3 mm region with some caution, but the predictions could also be quite reliable at considerably higher frequencies.
Spin-statistics do not have to be considered. The partition function takes into account higher values of Ka.
The dipole moment was assumed to agree with that of the main isotopic species, see e050503.cat.

Lines Listed35
Frequency / GHz< 300
Max. J35
log STR0-6.7
log STR1-4.5
Isotope Corr.-3.826
Egy / (cm-1)0.0
 µa / D4.1
 µb / D 
 µc / D 
 A / MHz195453.
 B / MHz4286.5
 C / MHz4189.2
 Q(300.0)29675.4514
 Q(225.0)19260.4452
 Q(150.0)10477.0917
 Q(75.00)3702.8713
 Q(37.50)1309.7369
 Q(18.75)460.4723
 Q(9.375)150.6022
detected in ISM/CSMyes


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