The experimental data was reported by
(1) M. J. Hopkinson, H. W. Kroto, J. F. Nixon,
and N. P. C. Simmons,
1976, Chem. Phys. Lett. 42, 460;
and by
(2) L. Bizzocchi, L. Cludi, and C. Degli Esposti,
2003, J. Mol. Spectrosc. 218, 53.
The purely K-dependent terms were taken from
CH3CN, see e.cat.
The predictions should be reliable throughout.
The dipole moment has been measured in (1).
|