Published November 18, 2025
| Version v1
Dataset
Open
Ni-Catalyzed Substrate-Controlled Enantiodivergence to Access Phosphorylated Oxindoles with Quaternary Stereocenters
Authors/Creators
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1.
Hong Kong Baptist University
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2.
Chinese University of Hong Kong
Description
DFT_optimized structures accompany the study "Ni-Catalyzed Substrate-Controlled Enantiodivergence to Access Phosphorylated Oxindoles with Quaternary Stereocenters". This dataset contain intermediates and transition state structures from 4 reaction step (oxidative addition, migratory insertion before anion exchange, migratory insertion after anion exchange, reductive elimination) for 2 model reactions (reaction using aryl iodide and using aryl triflate as starting materials).
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