Semiempirical molecular-orbital studies on the problem of nonclassical resonance in the homoallylic cation

✍ Scribed by A. S. N. Murthy; Shoba Ranganathan

• Book ID: 104580082
• Publisher: John Wiley and Sons
• Year: 1980
• Tongue: English
• Weight: 234 KB
• Volume: 18
• Category: Article
• ISSN: 0020-7608
• DOI: 10.1002/qua.560180612

✦ Synopsis

Abstract

The quantum‐mechanical methods (EHT and CNDO/2) have been applied to the homoallylic cation. Both methods successfully predict that the ion need not be represented as a nonclassical structure.