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Calculations of p-alkyltoluenes and their radicalcations by the MINDO/3 method
- Source :
- Theoretical and Experimental Chemistry; May 1990, Vol. 26 Issue: 3 p325-327, 3p
- Publication Year :
- 1990
-
Abstract
- p-Cymene and p-cyclopropyltoluene and their radical-cations were calculated by the LCAO-MO SCF method in the MINDO/3 valence approximation. It was shown that the radical-cations are stabilized through s,p conjugation of the methyl groups.
Details
- Language :
- English
- ISSN :
- 00405760 and 1573935X
- Volume :
- 26
- Issue :
- 3
- Database :
- Supplemental Index
- Journal :
- Theoretical and Experimental Chemistry
- Publication Type :
- Periodical
- Accession number :
- ejs15669342
- Full Text :
- https://doi.org/10.1007/BF00641343