Computational insights into different chemoselectivities in Rh2(ii)-catalyzed N-aryl nitrene and analogous Rh2(ii)/Cu(i)-catalyzed aryl-substituted carbene involving reactions

Computational studies were carried out to investigate the mechanisms and the origins of chemoselectivities among multiple reactive sites for Rh₂(ii)-catalyzed N-aryl nitrene and analogous Rh₂(ii)/Cu(i)-catalyzed aryl carbene involving reactions.