Azide-Alkyne Cycloaddition Catalyzed by Cu(I), Ag(I), and Au(I) Complexes and Influence of Deuterium Isotope: DFT-based Computational Insights

The azide–alkyne cycloaddition reaction, particularly its copper-catalyzed variant (CuAAC), remains a cornerstone of click chemistry due to its efficiency, regioselectivity, and broad applicability in fields such as pharmaceutical synthesis, material...