Magnetic circular dichroism spectra of triphenylene and coronene |
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| Authors: | Hiroyuki Yamaguchi Miwako Higashi |
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| Institution: | Department of Chemistry, Faculty of Science, Kumamoto University, Kurokami, Kumamoto 860, Japan |
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| Abstract: | The absorption spectra of triphenylene (I) and coronene (II) are assigned by using the MCD spectra and the results of the SCF screened potential π-MO CI calculations. The calculated Faraday A/D values for the 1E and 1E1u excited states of I and II are in excellent agreement with the experimental values, in contrast to the calculated Faraday B value for the 1E1u state of II. |
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