Gaseous-phase proton affinity of anilines: A quantum chemical evaluation and discussion in view of aqueous basicity
Using the PM3 method, enthalpies and free energies of the gaseous-phase proton affinity (PA) have been computed for aniline and 62 of its derivatives with different kinds of electron-donor and electron-acceptor substitution in the aromatic ring and at the nitrogen atom. Linear correlatio...
| Main Authors: | , , , |
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| Format: | Article |
| Language: | English |
| Published: |
Serbian Chemical Society
2001-01-01
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| Series: | Journal of the Serbian Chemical Society |
| Subjects: | |
| Online Access: | http://www.doiserbia.nb.rs/img/doi/0352-5139/2001/0352-51390103161P.pdf |