The potential energy surface for the thermal isomerization of fulvene to benzene was studied by modified Gaussian-2 (G2M) and the bond additivity-corrected fourth-order perturbation Mgller-Plesset (BAC-MP4) methods. Three isomerization pathways were investigated. One involves the intermediate preful
The photochemical Formation of Fulvene from Benzene via Prefulvene–a Theoretical Study
✍ Scribed by Dr. Jens Dreyer; Prof. Dr. Martin Klessinger
- Publisher
- John Wiley and Sons
- Year
- 1996
- Tongue
- English
- Weight
- 840 KB
- Volume
- 2
- Category
- Article
- ISSN
- 0947-6539
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