A carregar...
A polar nature of benzoic acids extrusion from nitroalkyl benzoates: DFT mechanistic study
Using DFT calculations at various theory levels, quantum-chemical simulations of decomposition paths were performed for a series of nitroalkyl benzoates. It was discovered, that these reactions proceed via polar, but one-step mechanism. It turned out that depending on the nature of the substituent i...
Na minha lista:
| Publicado no: | J Mol Model |
|---|---|
| Main Authors: | , |
| Formato: | Artigo |
| Idioma: | Inglês |
| Publicado em: |
Springer Berlin Heidelberg
2015
|
| Assuntos: | |
| Acesso em linha: | https://ncbi.nlm.nih.gov/pmc/articles/PMC4339780/ https://ncbi.nlm.nih.gov/pubmed/25711621 https://ncbi.nlm.nih.govhttp://dx.doi.org/10.1007/s00894-015-2592-6 |
| Tags: |
Adicionar Tag
Sem tags, seja o primeiro a adicionar uma tag!
|