N-Heterocyclic Carbenes & #x2013;Cu I Complexes as Catalysts: A Theoretical Insight

Nosheen Beig, Varsha Goyal, Raakhi Gupta, Raj K. Bansal The electronic structures of five representative N-heterocyclic carbenes and their CuI complexes were investigated at the DFT (B3LYP/def2-SVP) level.

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Source: Australian Journal of Chemistry - February 4, 2021 Category: Chemistry Authors: Nosheen Beig Varsha Goyal Raakhi Gupta Raj K. Bansal Source Type: research

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