A CNDO/S investigation of contact ct complexes of some organic molecules with O2

✍ Scribed by A.N. Dharamsi; J. Tulip

• Book ID: 103015754
• Publisher: Elsevier Science
• Year: 1980
• Tongue: English
• Weight: 356 KB
• Volume: 71
• Category: Article
• ISSN: 0009-2614
• DOI: 10.1016/0009-2614(80)80152-7

✦ Synopsis

A CNDO/S study of some organic contact charge-transier complexes mvolvtng the oxygen molecule tn an acceptor role shows charge-transfer stabtbzatton durtng randomly ortentated colbstons. m agreement wtth MuUdcen's experrmental work. Relevant donor and acceptor orbrtals are rdenhtied and relative posrtrons of evpznmental absorption bands reproduced.