INFRARED-SPECTROSCOPY OF MATRIX-ISOLATED POLYCYCLIC AROMATIC HYDROCARBON CATIONS .4. THE TETRACYCLIC PAH ISOMERS CHRYSENE AND 1,2-BENZANTHRACENE

Citation
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
Citations number
25
Categorie Soggetti
Chemistry Physical
ISSN journal
10895639
Volume
101
Issue
19
Year of publication
1997
Pages
3472 - 3477
Database
ISI
SICI code
1089-5639(1997)101:19<3472:IOMPAH>2.0.ZU;2-N
Abstract
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.