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Zero-field splitting in phosphorescent triplet states of aromatic hydrocarbons IV. Phenyl naphthalenes (1969)

Orloff, M. K. ; Brinen, J. S.

New York, NY : Wiley-Blackwell

International Journal of Quantum Chemistry 3 (1969), S. 225-230

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Details

ISSN: 0020-7608

Schlagwort(e): Computational Chemistry and Molecular Modeling ; Atomic, Molecular and Optical Physics

Quelle: Wiley InterScience Backfile Collection 1832-2000

Thema: Chemie und Pharmazie

Notizen: The zero-field splitting parameters D, E, and D* are calculated theoretically for four phenyl naphthalenes. Esr measurements show that the theoretical calculations are in good agreement with experiment. Comparison of the theoretical and experimental results gives some insight into the geometry of these molecules in their lowest triplet state.

Zusätzliches Material: 2 Tab.

Materialart: Digitale Medien

URL: http://dx.doi.org/10.1002/qua.560030208

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