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Computational Study of Factors Controlling the Boat and Chair Transition States of Ireland-Claisen Rearrangements

[Image: see text] The origins of the boat transition state preference in the Ireland-Claisen rearrangements studied experimentally by Kishi and co-workers have been explored computationally with Density Functional Theory and MO6-2X. Steric interactions in the chair transition states were identified...

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Autori principali: Gül, Şeref, Schoenebeck, Franziska, Aviyente, Viktorya, Houk, K. N.
Natura: Artigo
Lingua:Inglês
Pubblicazione: 2010
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Accesso online:https://ncbi.nlm.nih.gov/pmc/articles/PMC2837782/
https://ncbi.nlm.nih.gov/pubmed/20166688
https://ncbi.nlm.nih.govhttp://dx.doi.org/10.1021/jo100033d
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