Electronic Structure and Spectroscopic Studies of D 3 d -C60Cl30, a Chlorofullerene with a [18]Trannulene Ring, and Its Relation to Other [18]Trannulenes

Detailed spectroscopic characterization of D 3 d -C60Cl30, including IR, Raman, UV−vis absorption, and fluorescence spectra, is presented for the first time. Assignment of the vibrational spectra is proposed on the basis of density functional theory computations. Electronic structure and excitations...

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Veröffentlicht in:The journal of physical chemistry. A, Molecules, spectroscopy, kinetics, environment, & general theory Molecules, spectroscopy, kinetics, environment, & general theory, 2006-06, Vol.110 (23), p.7414-7421
Hauptverfasser: Popov, Alexey A, Senyavin, Vladimir M, Troyanov, Sergey I
Format: Artikel
Sprache:eng
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