A Theoretical Investigation of the Diethynylcyclobutadiene(cyclopentadienyl)cobalt Rearrangement
β Scribed by Priv.-Doz. Dr. Peter Hofmann; Prof. Dr. Thomas A. Albright
- Publisher
- John Wiley and Sons
- Year
- 1980
- Tongue
- English
- Weight
- 230 KB
- Volume
- 19
- Category
- Article
- ISSN
- 0044-8249
No coin nor oath required. For personal study only.
π SIMILAR VOLUMES
The structure and bonding of the Al&H4 radical complex and its positive and negative ions have been characterized by ab initio molecular orbital methods. It is found that electron correlation is csscntial to the binding. A symmetric n-complex between Al atom and CzH4 is the global minimum for AI&H4
The mechanism of the isomerization of allyl alcohols by the 1,3transposition of a hydroxy group, which is catalyzed by transition metal complexes in a high oxidation state, has been investigated by ab initio quantum chemical calculations for a trioxorhenium catalyst. The calculations point to a cycl