Unraveling mechanisms of the uncoordinated nucleophiles: theoretical elucidations of the cleavage of bis(p-nitrophenyl) phosphate mediated by zinc-complexes with apical nucleophiles

A theoretical approach was used to investigate the hydrolytic cleavage mechanisms of the bis(p-nitrophenyl) phosphate (BNPP(−)) catalyzed by Zn(ii)-complexes featuring uncoordinated nucleophiles. Ligand-based and alternative solvent-based nucleophilic attack reaction models are proposed. The pK(a) v...

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Detalles Bibliográficos
Autores principales: Zhou, Xiaoyu, Zhang, Xue-Peng, Li, Weikang, Jiang, Jingxing, Xu, Huiying, Ke, Zhuofeng, Phillips, David Lee, Zhao, Cunyuan
Formato: Online Artículo Texto
Lenguaje:English
Publicado: The Royal Society of Chemistry 2019
Materias:
Chemistry
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC9075727/
https://www.ncbi.nlm.nih.gov/pubmed/35541823
http://dx.doi.org/10.1039/c9ra06737j

Internet

https://www.ncbi.nlm.nih.gov/pmc/articles/PMC9075727/
https://www.ncbi.nlm.nih.gov/pubmed/35541823
http://dx.doi.org/10.1039/c9ra06737j

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