TY - JOUR
T1 - Diphenylmethane fulleroid C73H10
T2 - Am1 computational study
AU - Slanina, Zdenek
AU - Uhlik, Filip
AU - Fran§ois, Jean Pierre
AU - Adamowicz, Ludwik
N1 - Funding Information:
This work was supported by the National find for Scientific Research of
PY - 1993/5/1
Y1 - 1993/5/1
N2 - Diphenylmethane fulleroid C73H10 is studied by means of the AM1 quantum-chemical method. Full geometry optimization of its C2vstructure is performed together with vibrational harmonic analysis. The computed length of the C-C bond between two cage-hexagons bridged by the tetrahedral C atom is 1.565 A. Vibrational frequencies with a substantial IR intensity are reported.
AB - Diphenylmethane fulleroid C73H10 is studied by means of the AM1 quantum-chemical method. Full geometry optimization of its C2vstructure is performed together with vibrational harmonic analysis. The computed length of the C-C bond between two cage-hexagons bridged by the tetrahedral C atom is 1.565 A. Vibrational frequencies with a substantial IR intensity are reported.
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U2 - 10.1080/10641229308018362
DO - 10.1080/10641229308018362
M3 - Article
AN - SCOPUS:84946619226
SN - 1064-122X
VL - 1
SP - 189
EP - 198
JO - Fullerene Science and Technology
JF - Fullerene Science and Technology
IS - 2
ER -