Electrochemical C–N Coupling: A Review of Mechanistic Pathways and Computational Frameworks

Key Points

• This review aims to analyze the mechanistic pathways and computational frameworks involved in electrochemical C–N coupling.
• Comprehensive literature review of electrochemical C–N coupling techniques
• Analysis of mechanistic pathways in synthesis
• Evaluation of computational frameworks for modeling reactions
• Identified key mechanistic pathways for C–N coupling
• Highlighted the potential of using CO2 and N2 as feedstocks
• Outlined computational models that can predict reaction outcomes effectively

Abstract