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Computational Explorations of Mechanisms and Ligand-Directed Selectivities of Copper-Catalyzed Ullmann-Type Reactions

Computational investigations of ligand-directed selectivities in Ullmann-type coupling reactions of methanol and methylamine with iodobenzene by β-diketone- and 1,10-phenanthroline-ligated Cu(I) complexes are reported. Density functional theory (DFT) calculations with several functionals were perfor...

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Autors principals: Jones, Gavin O., Liu, Peng, Houk, K. N., Buchwald, Stephen L.
Format: Artigo
Idioma:Inglês
Publicat: 2010
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Accés en línia:https://ncbi.nlm.nih.gov/pmc/articles/PMC2908497/
https://ncbi.nlm.nih.gov/pubmed/20387898
https://ncbi.nlm.nih.govhttp://dx.doi.org/10.1021/ja100739h
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