Prototypes for aliphatic and aromatic diazonium ions. An ab initio study of the methane- and benzenediazonium ions
β Scribed by Vincent, Mark A.; Radom, Leo
- Book ID
- 121690420
- Publisher
- American Chemical Society
- Year
- 1978
- Tongue
- English
- Weight
- 783 KB
- Volume
- 100
- Category
- Article
- ISSN
- 0002-7863
No coin nor oath required. For personal study only.
π SIMILAR VOLUMES
Ah initlo calculations are reported For the systems .ti(H20)~' and Cu(H~0)z' with n up to 7. Tine cdcul2ted binding ene&s increase monotically up 10 ,I = 6, v&h equal binding energ& for IL = 6 2nd 7 foi Z& Al"'cation. AR estimate of the enihalpy of hydration of M3' \_ IS given, based on model calcuh
Both the abstraction and substitution mechanisms for the reaction of NHf with H-and the abstraction mechanisms for the reaction with LiH in the gas phase have been investigated by theoretical methods. LiH results to be a better reagent and reactions with and without scrambling are competitive in acc