Fig. 3 | Nature Communications

Fig. 3

From: A selenium-catalysed para-amination of phenols

Fig. 3

Computational studies on S (and Se)-mediated para-selective nitrogen migration of N-phenoxyacetamide (1a). a Computed Gibbs energy profile for S-mediated reaction (in TFE). b Computed Gibbs energy profile for Se-catalysed reaction (in 1,4-dioxane). c Transition states involved in S-mediated reaction. d Transition states involved in Se-catalysed condition

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