Mechanistic study of Cu Catalyzed Propargylic Substitution

Collection of structures computed for the proposed mechanism for the Cu catalyzed asymmetric propargylic sulfonylation.

Share - copy and redistribute the material in any medium or format. Adapt - remix, transform, and build upon the material for any purpose, even commercially. The licensor cannot revoke these freedoms as long as you follow the license terms.

Please use this identifier to cite or link to this collection:doi:10.19061/iochem-bd-1-248

This dataset derived results are published in:

Manuscript title: Comprehensive Mechanistic Scenario for the Cu-Mediated Asymmetric Propargylic Sulfonylation Forging Tertiary Carbon Stereocenters

Journal: J. Am. Chem. Soc.

DOI: 10.1021/jacs.3c00188

View as
    • ROOT
      • NLE
      • Nu_attack_scans
      • Redox
      • dispersion_interaction
        • pro-R
        • pro-S
      • mechanism_and_profile
        • I0
        • I0Nu
        • I1
        • I10
        • I11
        • I12
        • I13
        • I14
        • I2
        • I3
        • I4
        • I5
        • I6
        • I7
        • I8
        • I9
        • INu
        • TS1
        • TS2
        • TS3
        • TS4
        • other
      • other_bases
        • DABCO
        • NMeMor
        • TEA
      • scan_ring_opening