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Palladium Complexes with Phenoxy- and Amidate-Functionalized N-Heterocyclic Carbene Ligands Based on 3-Phenylimidazo[1,5-<i>a</i>]pyridine: Synthesis and Catalytic Application in Mizoroki–Heck Coupling Reactions with Ortho-Substituted Aryl Chlorides

Cheng‐Hau Hung, Wei-Yuan Zheng, Hon Man Lee

2021Organometallics12 citationsDOI

Abstract

Mononuclear and tetranuclear palladium complexes with functionalized “abnormal” N-heterocyclic carbene (aNHC) ligands based on 3-phenylimidazo[1,5-a]pyridine were synthesized. All of the new complexes were structurally characterized by single-crystal X-ray diffraction studies. The new complexes were applied in the Mizoroki–Heck coupling reaction of aryl chlorides with alkenes in neat n-tetrabutylammonium bromide (TBAB). The mononuclear palladium complex with a tridentate phenoxy- and amidate-functionalized aNHC ligand displayed activity superior to that of the palladium complex with a bidentate amidate-functionalized aNHC ligand. The new tetranuclear complex with the tridentate ligand displayed the best activities, capable of the activation of deactivated aryl chlorides as substrates with a low Pd atom loading. Even challenging sterically demanding ortho-substituted aryl chlorides were successfully utilized as substrates. The studies revealed that the robustness of the catalyst precursor is crucial in delivering high catalytic activities. Also, the promising use of tetranuclear palladium complexes with functionalized aNHC ligands as the catalyst precursors in the Mizoroki–Heck coupling reaction in neat TBAB was demonstrated.

Topics & Concepts

ChemistryPalladiumCarbenePyridineCatalysisHeck reactionMedicinal chemistryOrganic chemistryCombinatorial chemistryN-Heterocyclic Carbenes in Organic and Inorganic ChemistryCatalytic Cross-Coupling ReactionsCatalytic C–H Functionalization Methods