Classical Valence Similarity in Fullerene Derivatives |
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Authors: | Susumu Narita Takeshi Hamakawa Tetsuo Morikawa Tai-ichi Shibuya |
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Institution: | (1) Faculty of Textile Science and Technology, Shinshu University, Ueda, Japan, JP;(2) Department of Chemistry, Joetsu University of Education, Joetsu, Japan, JP |
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Abstract: | Summary. The generalized Pauling bond order was enumerated in the C60 fullerene cage molecule (truncated icosahedral symmetry). This index measures chemical similarity in fullerene derivatives
such as dihydrofullerene (C60H2), anionized monohydrofullerene (C60H−), N-substituted monohydrofullerene (C59NH), the fullerene dimer ((C60)2), and the dianionic fullerene dimer ((C60)2
2−). It is also useful in judging the chemical stability of isomers.
Received October 9, 2001. Accepted November 9, 2001 |
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Keywords: | , ,Chemical similarity, Unconjugated carbon site, C60 Fullerene derivative, Pauling bond order, Kekulé structure counting, |
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