Theoretical study of the orientation dependence of charge-transfer excitations 
in quinhydrones

Vogler, Helmut

doi:10.1515/znb-1983-0915

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Theoretical study of the orientation dependence of charge-transfer excitations in quinhydrones

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Vogler, Helmut
Department of Organic Chemistry, Max Planck Institute for Medical Research, Max Planck Society;

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Citation

Vogler, H. (1983). Theoretical study of the orientation dependence of charge-transfer excitations in quinhydrones. Zeitschrift für Naturforschung, B: A Journal of Chemical Sciences, 38(9), 1130-1135. doi:10.1515/znb-1983-0915.

Cite as: https://hdl.handle.net/21.11116/0000-0003-4EA6-B

Abstract

The two longest wavelength electronic transitions of the quinhydrones 1 and the dependence of transition energies and intensities on the mutual orientation of hydro-quinone and p-benzoquinone is studied within semiempirical π-theory. The results are in good agreement with the experimental UV-VIS spectra of closely related cyclophane-quinhydrones. The study is extended to the yet unknown quadruple-layered systems 2 which consist of two quinhydrone moieties.