| Article ID | Journal | Published Year | Pages | File Type |
|---|---|---|---|---|
| 5384317 | Chemical Physics Letters | 2011 | 8 Pages |
Abstract
⺠Deprotonation of C6H5X (X= H, F, Cl, OH, NH2, CN, CHO, NO2, CH3, C2H5, C2H3, C2H). ⺠G3B3 calculations of ÎacidH°, ÎacidG° and heats of formation of C6H5X. ⺠Experimental ÎacidH° of nitrobenzene is underestimated by 120 kJ/mol.
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Authors
Guy Bouchoux,