A carregar...
Dynamics and the Regiochemistry of Nitration of Toluene
The regiochemistry of the nitration of toluene by NO(2)(+)BF(4)(−) in dichloromethane is accurately predicted from trajectories in explicit solvent. Simpler models and approaches based on transition state theory fail to account for the selectivity. Potential of mean force calculations find no free-e...
Na minha lista:
| Publicado no: | J Am Chem Soc |
|---|---|
| Main Authors: | , |
| Formato: | Artigo |
| Idioma: | Inglês |
| Publicado em: |
2016
|
| Assuntos: | |
| Acesso em linha: | https://ncbi.nlm.nih.gov/pmc/articles/PMC5358517/ https://ncbi.nlm.nih.gov/pubmed/27794598 https://ncbi.nlm.nih.govhttp://dx.doi.org/10.1021/jacs.6b07328 |
| Tags: |
Adicionar Tag
Sem tags, seja o primeiro a adicionar uma tag!
|