The v5 = 1 experimental frequencies have been reported
by
(1) P. D. Mallinson and R. L. de Zafra,
1978, Mol. Phys. 36, 827; and by
(2) S. Thorwirth, H. S. P. Müller, and G. Winnewisser,
2001, Phys. Chem. Chem. Phys. 3, 1236.
The v7 = 3 state is about 5.0 cm1
lower than v5 = 1; this energy difference has been
derived from values of strongly interacting J communicated
by A. Fayt. One set of spectroscopic parameters is compatible with
these results, but it has an uncertainty of ±1 in J.
Strong interactions occur between v5 = 1 and
v7 = 3 for l = 1 / l = 3 near
J = 24; for l = 1f in both states
near J = 58; and for l = 1e near
J = 66. The l = 1e substate is
the one occuring generally at lower frequencies. A few J around
the strongly interacting levels predictions of transitions within
the corresponding substate are not reliable at the moment.
No experimental lines have been reported for v7 = 3
in the literatur to date. Therefore, spectroscopic parameters for
this state have been estimated. Some higher order parameters for
v5 = 1 have been estimated, too. The interaction
terms have been taken from the HCC13CN species, see (2)
and e052526.cat. The present parameter set differs slightly
from the one in (2). Because of the limited data set, predictions
for v5 = 1 are reliable up to 300 GHz at most
while predictions for v7 = 3 should be viewed with
caution throughout.
The state numbers 0 and 1 designate v5 = 1 and
v7 = 3, respectively.
The 14N hyperfine splitting has not been
considered in the present entry.
Note:
The partition function does not include vibrational
contributions. However, information on
vibrational contributions to the partition function
is available.
The dipole moments were assumed to be the same as for the
main species, v5 = 1 / v7 = 3, see e051508.cat.
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