| Autor: |
Böhm, Michael C., Bickert, Peter, Hafner, Klaus, Boekelheide, V. |
| Zdroj: |
Proceedings of the National Academy of Sciences of the United States of America; April 1984, Vol. 81 Issue: 8 p2589-2591, 3p |
| Abstrakt: |
The nature of the interaction between decks of a pentalene dimer and an s-indacene dimer has been studied by semi-empirical MNDO/1 and MINDO/3 calculations for distances between decks of from 5 Å to 2 Å. In contradiction to qualitative predictions from a frontier orbital analysis, it is found that the 4n-4nπ-electron interaction between decks for such dimers is destabilizing for distances exceeding about 2.5 Å. |
| Databáze: |
Supplemental Index |
| Externí odkaz: |
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