Dm. Hudgins et Lj. Allamandola, INFRARED-SPECTROSCOPY OF MATRIX-ISOLATED POLYCYCLIC AROMATIC HYDROCARBON CATIONS .4. THE TETRACYCLIC PAH ISOMERS CHRYSENE AND 1,2-BENZANTHRACENE, The journal of physical chemistry. A, Molecules, spectroscopy, kinetics, environment, & general theory, 101(19), 1997, pp. 3472-3477
The mid-infrared spectra of the polycyclic aromatic hydrocarbon (PAH)
cations of the tetracyclic isomers chrysene (C18H12+) and 1,2-benzanth
racene (C18H12+) are presented. As with previous PAH cations studied t
o date, the CC stretching and CH in-plane bending mode absorptions are
about an order of magnitude stronger than the aromatic CH out-of-plan
e bending absorptions and nearly 2 orders of magnitude more intense th
an the corresponding bands in the neutral molecule. The CH bands arisi
ng from the out-of-plane bends in the cation are slightly weaker than
the corresponding bands in the neutral species. The strongest cation b
ands of these species fall between 1300 and 1330 cm(-1), close to the
peak of the most intense interstellar emission feature in HII regions
and reflection nebulae. A strong PAH cation band at slightly higher fr
equency than 1300 cm(-1) may be associated with an asymmetric CC stret
ching vibration involving rings adjacent to the kink in the chain of a
romatic rings.