Theoretical calculations of magnetic moments of mono-cyclic conjugated hydrocarbons |
| |
Authors: | A. Tajiri H. Uchimura M. Hatano |
| |
Affiliation: | The Chemical Research of Non-aqueous Solutions, Tohoku University, Sendai, Japan |
| |
Abstract: | The magnetic moments of excited states of mono-cyclic non-alternant conjugated hydrocarbons with 3-9 carbon atoms were theoretically calculated using wavefunctions determined on the basis of the LCAO MO method. The predicted value is in good agreement with experiment for the tropylium cation. |
| |
Keywords: | |
本文献已被 ScienceDirect 等数据库收录! |