E-2-Butenenitrile is lower in energy than Z-2-butenenitrile.
The conversion requires a formal rotation around a double bond.
Therefore, the two species are considered as separate isomers.
The experimental lines were taken mostly from
(1) A. G. Lesarri, J. Cosléou, X. Li, G. Wlodarczak,
and J. Demaison,
1995, J. Mol. Spectrosc. 172, 520.
Also included in the fit were microwave transitions
from
(2) S. L. Hsu and W. H. Flygare,
1971, J. Mol. Spectrosc. 37, 92.
Some additional spectroscopic parameters were used,
in part estimated. b-type transitions were not
calculated because they are weak and apparently affected
by substantial internal rotation splitting. Such splitting
appears to be negligible for a-type transitions,
except maybe for some transitions with low values
of J. 14N hyperfine splitting
is also negligible, except at lower J.
The calculation should be suitable for most observational
purposes.
Transition frequencies with calculated uncertainties
exceeding 0.2 MHz should be viewed with caution.
The a-dipole moment component is from
(3) M. Suzuki and K. Kozima,
1970, J. Mol. Spectrosc. 33, 407.
The b-component is quite uncertain.
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