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DFT calculation indicates that in iridium catalyzed C–H borylation of aromatics, the  ortho  selectivity is proposed to be attributed to the electron donating effect of AQ ligand, while the  meta  selectivity is due to steric hindrance of TMP ligand.

Mechanistic study of the ligand controlled regioselectivity in iridium catalyzed C–H borylation of aromatic imines