Mechanistic investigation of the transfer hydrogenation of alkynes catalysed by an MLC catalyst with multiple ancillary ligand sites

Mechanistic insight into the borrowing-hydrogen N-alkylation catalyzed by an MLC catalyst with dual proton-responsive sites

Exploring the conversion mechanism of formaldehyde to CO2 and H2 catalyzed by bifunctional ruthenium catalysts: A DFT study

Mechanistic insight into the isomerization of allyl alcohol catalyzed by the Co(II)-PNP catalyst: Crucial role of spectator ligand

Transition metal center effect on the mechanism of homogenous hydrogenation and dehydrogenation

The origin of different driving forces between O–H/N–H functional groups in metal ligand cooperation: mechanistic insight into Mn(i) catalysed transfer hydrogenation

A DFT study of Co(I) and Ni(II) pincer complex-catalyzed hydrogenation of ketones: intriguing mechanism dichotomy by ligand field variation

When Bifunctional Catalyst Encounters Dual MLC Modes: DFT Study on the Mechanistic Preference in Ru-PNNH Pincer Complex Catalyzed Dehydrogenative Coupling Reaction

DFT Study of Acceptorless Alcohol Dehydrogenation Mediated by Ruthenium Pincer Complexes: Ligand Tautomerization Governing Metal Ligand Cooperation

Unusual non-bifunctional mechanism for Co-PNP complex catalyzed transfer hydrogenation governed by the electronic configuration of metal center

Hydrogenation of Carbon Dioxide Using Half-Sandwich Cobalt,Rhodium, and Iridium Complexes: DFT Study on the Mechanism and Metal Effect