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A Computational Study of the Origin of Stereoinduction in NHC-Catalyzed Annulation Reactions of α,β-Unsaturated Acyl Azoliums

The origin of stereoselectivity of NHC-catalyzed annulation reactions of ynals and stable enols was studied with Density Functional Theory. The data suggest that the C-C bond formation is the stereo-determining step. Only the deprotonated pathway (containing an oxy anion and overall neutral species)...

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Detalhes bibliográficos
Main Authors: Lyngvi, Eirik, Bode, Jeffrey W., Schoenebeck, Franziska
Formato: Artigo
Idioma:Inglês
Publicado em: 2012
Assuntos:
Acesso em linha:https://ncbi.nlm.nih.gov/pmc/articles/PMC3655779/
https://ncbi.nlm.nih.gov/pubmed/23687566
https://ncbi.nlm.nih.govhttp://dx.doi.org/10.1039/C2SC20331F
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