gG'a-CH3CHOHCH2OH
1,2-Propanediol, gG'a conformer
Species tag 076515
Version2*
Date of EntryAug. 2014
ContributorH. S. P. Müller
J.-B. Bossa

Rotational spectra of several conformers of 1,2-propanediol have been studied very recently by
(1) F. J. Lovas, D. F. Plusquellic, B. H. Pate, J. L. Neill, M. T. Muckle, and A. J. Remijan, 2009, J. Mol. Spectrosc. 257, 82.
The aG'g conformer was found to be the lowest one with the gG'a conformer calculated to be 106 K higher in energy and the g'G'g conformer 165 K higher. Other conformers were calculated to be more than 300 K higher.
With respect to the first entry from Mar. 2011, extensive new data were reported by
(2) J.-B. Bossa, M. H. Ordu, H. S. P. Müller, F. Lewen, and S. Schlemmer, 2014, Astron. Astrophys. 570, Art. No. A12.
In addition, low frequency data from (1) were used.
The predictions are expected to be sufficient for all astronomical observations. Predictions with uncertainties larger than 0.3 MHz should be viewed with caution.
The dipole moment was determined in (1).

Lines Listed64243
Frequency / GHz< 1000
Max. J158
log STR0-10.0
log STR1-7.0
Isotope Corr.-0.0
Egy / (cm–1)0.0
 µa / D2.496
 µb / D0.309
 µc / D0.45
 A / MHz8393.401
 B / MHz3648.560
 C / MHz2778.302
 Q(300.0)95173.2403
 Q(225.0)61792.5747
 Q(150.0)33621.3325
 Q(75.00)11884.1757
 Q(37.50)4203.0605
 Q(18.75)1487.5606
 Q(9.375)527.1371
detected in ISM/CSMno


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