Structure and spectroscopic properties of cyclodextrin inclusion complexes |
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| Authors: | G. Köhler G. Grabner C. TH. Klein G. Marconi B. Mayer S. Monti K. Rechthaler K. Rotkiewicz H. Viernstein P. Wolschann |
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| Affiliation: | (1) Institute for Theoretical Chemistry and Radiation Chemistry, University of Vienna, Althanstraße 14, 1090 Vienna, Austria;(2) Italian Council for Research (CNR), Institute of Photochemistry and High Energy Radiation, Via P. Gobetti 101, 40129 Bologna, Italy;(3) Polish Academy of Sciences, Institute for Physical Chemistry, Kasprzaka 44-52, PL-01-224 Warsaw, Poland;(4) University of Vienna, Institute for Pharmaceutical Technology, Althanstra!["beta"]("/content/k0287574u6v32125/xlarge946.gif") e 14, 1090 Vienna, Austria |
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| Abstract: | We compare spectroscopic properties of higher order complexes of organic guests (e.g. naphthalene, phenols, indole, C60 fullerene) with cyclodextrins (CDx) to results of molecular modeling investigations. Naphthalene 1:2 complexes with  -CDx show high spectral resolution and peculiar triplet properties. Molecular simulations and calculation of the experimentally measured induced circular dichroism (ICD) provide detailed structural information. |
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