NiCO
Nickel monocarbonyl, X 1Σ+, 58Ni isotopomer
Species tag 086502
Version1
Date of EntryMar. 2004
ContributorH. S. P. Müller

The experimental lines were taken from
(1) E. Yamazaki, T. Okabayashi, and M. Tanimoto, 2004, J. Am. Chem. Soc. 126, 1028.
The dipole moment is from an ab initio calculation by
(2) G. L. Gutsev, L. Andrews, and C. Bauschlicher Jr., 2003, Chem. Phys. 290, 47.
The ab initio dipole moments of transition metal compounds should be viewed with some caution.

Lines Listed99
Frequency / GHz< 893
Max. J99
log STR0-5.7
log STR1-3.4
Isotope Corr.-0.1716
Egy / cm-10.0
 µa / D3.4
 µb / D 
 µc / D 
 A / MHz 
 B / MHz4529.98
 C / MHz 
 Q(300.0)1381.1955
 Q(225.0)1035.8048
 Q(150.0)690.5282
 Q(75.00)345.3712
 Q(37.50)172.8377
 Q(18.75)86.5823
 Q(9.375)43.4581
detected in ISM/CSMno


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