N-Heterocyclic Carbenes–CuI Complexes as Catalysts: A Theoretical Insight
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DOI: 10.1071/ch20332
Abstract: The electronic structures of N-heterocyclic carbenes (NHC) imidazolinylidene, thiazolinylidene, imidazolylidene, thiazolylidene, and 1,2,4-triazolylidene and their complexes with cuprous halides (CuX, X = Cl, Br, I) were investigated theoretically at the B3LYP/def2-SVP level. In contrast to other NHCs,… read more here.
Keywords: heterocyclic carbenes; cui complexes; nhc cui; cuprous halides ... See more keywords