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Mechanistic study of Cu Catalyzed Propargylic Substitution Collection home page

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

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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
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