过渡金属参与C―H键切断模式的理论研究进展

单春晖,白若鹏,蓝宇

Theoretical Advances of Transition Metals Mediated C―H Bonds Cleavage

Chunhui SHAN,Ruopeng BAI,Yu LAN

图9 外源碱去质子化模式的C―H键活化的活化能 (a) Pd-mediated C―H trifluoroethylation of indoles (computational method: DFT with the M11-L functional in dimethylformamide solvent); (b) zinccatalyzed oxidative coupling of benzaldehyde (computational method: DFT with the M11-L functional in toluene solvent). The bond lengths are in angstroms.

Fig 9 Activation free energies of utersphere base-assisted deprotonation-type C―H cleavage