Published July 27, 2025 | Version v2
Dataset Open

Additive-controlled Regio-switching in Ni-catalyzed Enantioselective Hydrophosphination of Unactivated Alkenes

Authors/Creators

Description

This folder contains the DFT-optimized geometries (in .xyz format together with the gas-phase energy, E) accompanying the paper

"

Additive-controlled Regio-switching in Ni-catalyzed Enantioselective Hydrophosphination of Unactivated Alkenes

"

Where conformers occur, they are always named from the lowest Gibbs energy to the highest in ascending order from c1 (sometimes omitted), c2, c3, ...

Files

DFT_optimized_structures.zip

Files (81.9 kB)

Name Size Download all
md5:b8c88ede773fa0bd4ff6d82aed3d29d3
81.9 kB Preview Download