Ni-Catalyzed Substrate-Controlled Enantiodivergence to Access Phosphorylated Oxindoles with Quaternary Stereocenters
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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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Zenodo创建时间:
2025-12-03



