Abstract
Excited singlet and triplet states of fluorobenzene, aniline, nitrobenzene, toluene, phenol, and phenoxide ion have been calculated using the AM1 semi-empirical method. Electronic transitions have been predicted and compared with experimental values when available. © 1988.
Original language | English |
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Pages (from-to) | 1427-1434 |
Journal | Spectrochimica Acta Part A: Molecular Spectroscopy |
Volume | 44 |
Issue number | 12 |
DOIs | |
Publication status | Published - 1 Jan 1988 |