Swern oxidation, TS1-endo, B3LYP+GD3+BJ/Def2-QZVPP, SCRF= IEFPCM,chloroform, => 1HCCl3 explicit solvents, G = -2243.107354
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https://data.hpc.imperial.ac.uk/resolve/?doi=13276
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资源简介:
Gaussian 16 (C01) calculation
提供机构:
Imperial College London
创建时间:
2023-09-20



