Spectroscopic studies of 12-oxo-5(12H)-naphthacenylidene and 7H-benz[de]anthracen-7-ylidene in Shpolskii matrixes at 5 K

Citation
M. Aloshyna et al., Spectroscopic studies of 12-oxo-5(12H)-naphthacenylidene and 7H-benz[de]anthracen-7-ylidene in Shpolskii matrixes at 5 K, J PHYS CH A, 104(15), 2000, pp. 3391-3397
Citations number
29
Categorie Soggetti
Physical Chemistry/Chemical Physics
Journal title
JOURNAL OF PHYSICAL CHEMISTRY A
ISSN journal
10895639 → ACNP
Volume
104
Issue
15
Year of publication
2000
Pages
3391 - 3397
Database
ISI
SICI code
1089-5639(20000420)104:15<3391:SSO1A7>2.0.ZU;2-P
Abstract
The triplet-triplet fluorescence and fluorescence excitation spectra of two new, planar diaryl carbenes in n-hexane and n-heptane were studied at cryo genic temperatures. Fluorescence decays were fitted to three exponential fu nctions. Fluorescence decays of 12-oxo-5(12H)-naphthacenylidene were sensit ive to the presence of a magnetic field, and this dependence allowed the es timation of the zero field splitting parameters (D) of the excited triplet state of this compound, which were 0.037 +/- 0.010 and 0.03 +/- 0.015 cm(-1 ) for the low- and high-energy sites, respectively. These results are corro borated by computational studies of the ground-state preferences and the tr iplet excitation energies.