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Interpreting Oxidative Addition of Ph–X (X = CH(3), F, Cl, and Br) to Monoligated Pd(0) Catalysts Using Molecular Electrostatic Potential
[Image: see text] A B3LYP density functional theory study on the oxidative addition of halogenobenzenes and toluene to monoligated zerovalent palladium catalysts (Pd–L) has been carried out using the “L” ligands such as phosphines, N-heterocyclic carbenes, alkynes, and alkenes. The electron deficien...
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| Publicado no: | ACS Omega |
|---|---|
| Main Authors: | , |
| Formato: | Artigo |
| Idioma: | Inglês |
| Publicado em: |
American Chemical Society
2017
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| Acesso em linha: | https://ncbi.nlm.nih.gov/pmc/articles/PMC6641867/ https://ncbi.nlm.nih.gov/pubmed/31457715 https://ncbi.nlm.nih.govhttp://dx.doi.org/10.1021/acsomega.7b00745 |
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