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Immobilization of Ir(I) complex on covalent triazine frameworks for C H borylation reactions: A combined experimental and computational study

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Abstract Metal-modified covalent triazine frameworks (CTFs) have attracted considerable attention in heterogeneous catalysis due to their strong nitrogen-metal interactions exhibiting superior activity, stability and hence recyclability. Herein, we report on… Click to show full abstract

Abstract Metal-modified covalent triazine frameworks (CTFs) have attracted considerable attention in heterogeneous catalysis due to their strong nitrogen-metal interactions exhibiting superior activity, stability and hence recyclability. Herein, we report on a post-metalation of a bipyridine-based CTFs with an Ir(I) complex for C H borylation of aromatic compounds. Physical characterization of the Ir(I)-based bipyCTF catalyst in combination with density functional theory (DFT) calculations exhibit a high stabilization energy of the Ir-bipy moiety in the frameworks in the presence of B 2 Pin 2 . By using B 2 Pin 2 as a boron source, Ir(I)@bipyCTF efficiently catalyzed the C H borylation of various aromatic compounds with excellent activity and good recyclability. In addition, XAS analysis of the Ir(I)@bipyCTF gave clear evidence for the coordination environment of the Ir.

Keywords: covalent triazine; triazine frameworks; immobilization complex; borylation; complex covalent

Journal Title: Journal of Catalysis
Year Published: 2019

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