C6D
Hexatriynyl, X 2Πi; deuterated isotopomer
Species tag 074512
Version1*
Date of EntryDec. 2005
ContributorH. S. P. Müller

The lines have been reported by
(1) H. Linnartz, T. Motylewski, O. Vaizert, J. P. Maier, A. J. Apponi, M. C. McCarthy, C. A. Gottlieb, and P. Thaddeus, 1999, J. Mol. Spectrosc. 197, 1.
The fit has been carried out using constants and quantum numbers of Hund's case (b). Some higher order terms have been estimated from respective C6H values. The large number of centrifugal distortion terms needed to fit the data within experimental uncertainties seem to indicate the ground vibronic state of C6D to be perturbed by a low lying vibrational or electronic state. Further, because of the number of these terms predictions above 200–250 GHz should be viewed with caution.
At low frequencies, the 2D hyperfine splitting has been resolved both in the laboratory and may be resolvable in space. Therefore, separate predictions with hyperfine splitting are available for N' ≤ 15. NOTE: the partition function does take into account the hyperfine splitting !
The dipole moment is assumed to agree with that of the main isotopic species, see e073501.cat.

Lines Listed746
Frequency / GHz< 497
Max. J187
log STR0-7.0
log STR1-4.0
Isotope Corr.-3.967
Egy / (cm–1)0.0
 µa / D5.54
 µb / D 
 µc / D 
 A 
 B1327.85
 C 
 Q(300.0)54505.7842
 Q(225.0)40401.2602
 Q(150.0)26321.6352
 Q(75.00)12329.7975
 Q(37.50)5499.2458
 Q(18.75)2320.1861
 Q(9.375)978.9382
detected in ISM/CSMno


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