CH3-I-CC CCSD(T)/Def2-TZVPPD/SCRF=DCM E -412.8495128 (reactant) TS migration from reactant E = 412.7893362 (13.7 below CC + IMe) G = -412.777622

Name: CH3-I-CC CCSD(T)/Def2-TZVPPD/SCRF=DCM E -412.8495128 (reactant) TS migration from reactant E = 412.7893362 (13.7 below CC + IMe) G = -412.777622
Creator: Imperial College London
Published: 2020-06-13T05:44:14+08:00