遇见数据集

Computation Output Files for "Cu-Catalyzed Diastereo- and Enantioselective Synthesis of Homopropargyl Amines Bearing All-Carbon Quaternary Stereocenters via Chirality Transfer of Hindered Allenylcopper Species"

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Zenodo2024-12-03 更新2026-04-07 收录
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This dataset contains the output files from computations performed for the study titled "Cu-Catalyzed Diastereo- and Enantioselective Synthesis of Homopropargyl Amines Bearing All-Carbon Quaternary Stereocenters via Chirality Transfer of Hindered Allenylcopper Species". The calculations were carried out using Gaussian16 with the B3LYP-D3/{SDD for Cu, 6-311G(d)}thf(CPCM) method.

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2024-12-03
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