Article ID | Journal | Published Year | Pages | File Type |
---|---|---|---|---|
5394592 | Computational and Theoretical Chemistry | 2012 | 4 Pages |
Abstract
⺠C60 reaction with tetrazine-derivatives gave a functionalized-C60 via cycloaddition. ⺠Reaction energies for molecules with different functionals are â1.26 to â2.17 eV. ⺠Relative magnitude order of reaction energies is -NO2 > -CN > -H > -CH3 > -NH2 > -Ph.
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Physical Sciences and Engineering
Chemistry
Physical and Theoretical Chemistry
Authors
Javad Beheshtian, Ali Ahmadi Peyghan, Zargham Bagheri,