A combined density functional theory and numerical simulation investigation of levels of chirality transfer and regioselectivity for the radical cyclizations of N-methyl-, N-ethyl- and N-isopropyl-substituted ortho-halo-N-acryloylanilides
Author:
Affiliation:
1. Key Laboratory of Functional Inorganic Material Chemistry (Ministry of Education of China)
2. School of Chemistry and Materials Science
3. Heilongjiang University
4. Harbin 150080
5. China
Abstract
There is a high chirality transfer ratio when the N-alkyl substituent is larger in volume than isopropyl.
Funder
National Natural Science Foundation of China
Publisher
Royal Society of Chemistry (RSC)
Subject
Materials Chemistry,General Chemistry,Catalysis
Link
http://pubs.rsc.org/en/content/articlepdf/2018/NJ/C8NJ01102H
Reference102 articles.
1. Free radical-mediated ring expansion and related annulations
2. Free radical cyclizations involving nitrogen
3. Programming Organic Molecules: Design and Management of Organic Syntheses through Free-Radical Cascade Processes
4. Stereoselective radical reactions
5. Formation of five- and six-membered heterocyclic rings under radical cyclisation conditions
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1. Does the Neophyl-like Rearrangement Play a Decisive Role in Intramolecular Cyclization of Iminyl Radicals? A Combined Quantum Chemistry and Numerical Simulation Investigation of the Cyclization Mechanism and Product Distributions of Bicyclic 2-Allyl-2-methyl-2,3-dihydro-1H-inden-1-iminyl Radical and Several Iminyl Model Compounds;The Journal of Organic Chemistry;2019-01-29
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