Extended CNDO calculations upon benzonitrile and ethynylbenzene
- 1 June 1972
- journal article
- Published by Elsevier in Journal of Molecular Spectroscopy
- Vol. 42 (3), 514-522
- https://doi.org/10.1016/0022-2852(72)90226-3
Abstract
No abstract availableThis publication has 18 references indexed in Scilit:
- Electric-Field-Induced Perturbations in the Ultraviolet Spectra of Polyatomic Molecules; the 1B2 State of BenzonitrileThe Journal of Chemical Physics, 1971
- Ethynylbenzene analysis of the 2790 Å absorption systemJournal of Molecular Spectroscopy, 1971
- Ethynylbenzene calculations of energies of electronic statesJournal of Molecular Spectroscopy, 1971
- On transitions in aromatic hydrocarbonsJournal of Molecular Spectroscopy, 1971
- Rotational analysis of the 2738 Å band of benzonitrileJournal of Molecular Spectroscopy, 1970
- Use of the CNDO Method in Spectroscopy. III. Monosubstituted Benzenes and PyridinesThe Journal of Chemical Physics, 1968
- Use of the CNDO Method in Spectroscopy. II. Five-Membered RingsThe Journal of Chemical Physics, 1968
- Use of the CNDO Method in Spectroscopy. I. Benzene, Pyridine, and the DiazinesThe Journal of Chemical Physics, 1968
- A QUANTUM-THEORETICAL STUDY OF SOME AROMATIC NITRILES BY THE SEMIEMPIRICAL LCAO–SCF–MO METHODCanadian Journal of Chemistry, 1965
- Vacuum ultraviolet spectra of styrene, benzaldehyde, acetophenone, and benzonitrileTheoretical Chemistry Accounts, 1965