C5H
Pentadiynylidyne, X 2Πr
Species tag 061505
Version2*
Date of EntryMay 2015
ContributorH. S. P. Müller
M. C. McCarthy

With respect to the first entry from Mar. 2006, the parameter set was modified slightly, and the parity was altered for consistency reasons. Most of the 2Π1/2 hyperfine split transition frequencies have been reported by
(1) M. C. McCarthy, W. Chen, A. J. Apponi, C. A. Gottlieb, and P. Thaddeus, 1999, Astrophys. J. 520, 158.
Additional millimeter lines without hyperfine splitting were kindly provided by
(2) M. C. McCarthy, 2005, private communication.
The fit has been carried out employing parameters and quantum numbers of Hund's case (b), as usual. Concerning Hund's case (a) quantum numbers, levels with J + 0.5 = N correlate with 2Π1/2 and levels with J – 0.5 = N correlate with 2Π3/2 for J ≤ 11.5; the correlation is reversed for J ≥ 12.5.
Predictions for the hyperfine splitting in the higher lying 2Π3/2 spin component as well as those for transitions above 400 GHz should be viewed with caution.
The dipole moment is from an ab initio calculation by
(3) D. E. Woon, 1995, Chem. Phys. Lett. 244, 45.

Lines Listed1130
Frequency / GHz< 670
Max. J140
log STR0-7.5
log STR1-4.3
Isotope Corr.-0.0234
Egy / (cm–1)0.0
 µa / D4.88
 µb / D 
 µc / D 
 A 
 B2395.127
 C 
 Q(300.0)19751.0455
 Q(225.0)14550.0788
 Q(150.0)9369.4793
 Q(75.00)4259.7283
 Q(37.50)1828.1290
 Q(18.75)760.1392
 Q(9.375)338.6937
 Q(5.000)178.0943
 Q(2.725)98.5154
detected in ISM/CSMyes


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