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Effect of deprotonation on the magnetic exchange coupling constant of fluorene‐based verdazyl diradical: A computational study.
- Source :
-
International Journal of Quantum Chemistry . Jun2018, Vol. 118 Issue 11, p1-1. 8p. - Publication Year :
- 2018
-
Abstract
- Abstract: The magnetic behavior of the fluorene bridged verdazyl diradicals has been studied theoretically in their neutral and deprotonated states. The deprotonation of C9‐H site of the fluorene ring opens a new coupling pathway, which changes the nature of magnetic coupling. The transmission spectra analysis reveals that the transmission through fluorine has also increased due to the opening of a new coupling path after deprotonation. [ABSTRACT FROM AUTHOR]
Details
- Language :
- English
- ISSN :
- 00207608
- Volume :
- 118
- Issue :
- 11
- Database :
- Academic Search Index
- Journal :
- International Journal of Quantum Chemistry
- Publication Type :
- Academic Journal
- Accession number :
- 129103225
- Full Text :
- https://doi.org/10.1002/qua.25543