The Pinacol rearrangement.

DOI: 10.14469/hpc/1769 Metadata

Created: 2016-10-17 09:10

Last modified: 2023-06-14 08:16

Author: Henry Rzepa

License: Creative Commons: Public Domain Dedication 1.0

Funding: (none given)

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DOIDescription
10.14469/hpc/12669 Pinacol rearrangement
10.14469/hpc/12670 Pinacol rearrangement, B3LYP+GD3+BJ/Def2-TZVPP, G = -387.949686
10.14469/hpc/12671 Pinacol rearrangement, IRC
10.14469/hpc/12673 Pinacol rearrangement + HCl, TS, Def2-TZVPP, G = -848.381426
10.14469/hpc/12676 Pinacol rearrangement, Def2-TZVPP, G = -387.949686
10.14469/hpc/12681 Pinacol rearrangement + HCl + Cl(-), TS, Def2-TZVPP, G = -1308.801780
10.14469/hpc/12680 Pinacol rearrangement, Def2-TZVPP, G = -387.949686 IRC
10.14469/hpc/12685 Pinacol rearrangement, Def2-TZVPP, G = -387.949686 TS NBO
10.14469/hpc/12686 Pinacol rearrangement, Def2-TZVPP, G = -387.949686 IRC ==> Reactant NBO

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