Reductive elimination, cationic ion with loss of I(-), MN11L/Def2-TZVPP, G = -3338.172265 + -298.425149 = -3,636.597414 (DDG = 0.93) @T355P=58 G = -3338.189081 ==> -3,636.613371, DG = 19.3
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Gaussian 16 (C01) calculation
创建时间:
2023-12-18



