Halogen atom transfer, doublet for Cu_I after halogen transfer, wB97XD/ Def2-TZVPP, G= -3404.440925 + -231.500139 ==> -3,635.941064, ΔG = 35.2 @T355P58 G = -3404.456649 @T355P58 G = -3404.456649

Name: Halogen atom transfer, doublet for Cu_I after halogen transfer, wB97XD/ Def2-TZVPP, G= -3404.440925 + -231.500139 ==> -3,635.941064, ΔG = 35.2 @T355P58 G = -3404.456649 @T355P58 G = -3404.456649
Creator: Imperial College London
Published: 2023-08-06T06:26:20+08:00