Article ID | Journal | Published Year | Pages | File Type |
---|---|---|---|---|
5393593 | Computational and Theoretical Chemistry | 2014 | 6 Pages |
Abstract
- Reactions of methyl α,p-dinitrocinnamate with vinyl-alkyl ethers have a polar nature.
- Zwitterions may arise during their course reactions.
- Regioselectivity of reactions can be explained on the basis of electrophilicity indices theory.
- M062x functional overestimates activation energies.
Related Topics
Physical Sciences and Engineering
Chemistry
Physical and Theoretical Chemistry
Authors
Radomir JasiÅski,