Rappe Rearrangement. FAIR Data Table 2. Free energies for Cyclisation of dibromoenols. TS2

DOI: 10.14469/hpc/11227 Metadata

Created: 2022-09-26 14:07

Last modified: 2025-05-07 10:50

Author: Henry Rzepa

License: Creative Commons: Public Domain Dedication 1.0

Funding: (none given)

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Gaussian 16 calculations

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DOIDescription
10.14469/hpc/11051 Rappe Rearrangement. The origin of cis-stereoselectivity in the conversion of 2,3-dibromo-2-methyl-cyclopropan-1-one to (Z)-but-2-enoic acid. TS2 pathway

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