The non-innocent role of the halide ligand in the copper-catalyzed olefin aziridination reaction

DFT optimization and single point calculations of the structures

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The original dataset source can be reviewed here
Please use this identifier to cite or link to this collection:doi:10.19061/iochem-bd-1-255

This dataset derived results are published in:

Manuscript title: The non-innocent role of the halide ligand in the copper-catalyzed olefin aziridination reaction

Journal: ACS Catal.

View as
    • ROOT
      • Cationic_system
        • SP
      • Cl_system
        • SP
      • MECP
        • MECP4
          • Cat
          • Cl
        • MECP5
          • Cat
          • Cl
      • Retention
        • MECP5trans
      • common
        • SP