The perturbational treatment of the process of hydrogen abstraction by ketones
Data(s) |
1979
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Resumo |
The change in energy during hydrogen abstraction by ketones is estimated for different electronic states as a function of the intermolecular orbital overlap employing perturbation theory. The results suggest that ketones preferentially undergo the in-plane reaction and abstract a hydrogen atom in their triplet nπ* state. For ketones where the triplet ππ* state lies below the triplet nπ* state, hydrogen abstraction can take place in the ππ* state owing to the crossing of the zero order reaction surfaces of the nπ* and ππ* states. |
Formato |
application/pdf |
Identificador |
http://eprints.iisc.ernet.in/24343/1/1.pdf Chandra, AK (1979) The perturbational treatment of the process of hydrogen abstraction by ketones. In: Journal of Photochemistry, 11 (5). pp. 347-360. |
Publicador |
Elsevier Science |
Relação |
http://www.sciencedirect.com/science?_ob=ArticleURL&_udi=B6W96-44W5CWP-17&_user=512776&_rdoc=1&_fmt=&_orig=search&_sort=d&_docanchor=&view=c&_acct=C000025298&_version=1&_urlVersion=0&_userid=512776&md5=a19ff1403d0420b62fd503532c058048 http://eprints.iisc.ernet.in/24343/ |
Palavras-Chave | #Inorganic & Physical Chemistry |
Tipo |
Journal Article PeerReviewed |