Understanding the molecular mechanism of γ‐elimination of nitrous acid in the framework of the molecular electron density theory
Author:
Affiliation:
1. Cracow University of Technology Institute of Organic Chemistry and Technology Cracow Poland
Funder
Infrastruktura PL-Grid
Publisher
Wiley
Subject
Computational Mathematics,General Chemistry
Link
https://onlinelibrary.wiley.com/doi/pdf/10.1002/jcc.26532
Reference46 articles.
1. Cycloaddition des Méthylazide et Phénylazide au β-Nitrostyrène et au Nitropropène Homologue
2. Isomerisation of nitroolefines. II. Isomerisation reaction of nitroethylene
3. On the mechanism of the thermal N-nitropyrazole rearrangement. Evidence for a [1,5] sigmatropic nitro migration
4. Domino reaction of 3-nitro-2-(trifluoromethyl)-2H-chromenes with 2-(1-phenylalkylidene)malononitriles: synthesis of functionalized 6-(trifluoromethyl)-6H-dibenzo[b,d]pyrans and a rare case of [1,5] sigmatropic shift of the nitro group
5. A DFT computational study on the molecular mechanism of the nitro group migration in the product derived from 3-nitro-2-(trifluoromethyl)-2 H -chromene and 2-(1-phenylpropylidene)malononitrile
Cited by 2 articles. 订阅此论文施引文献 订阅此论文施引文献，注册后可以免费订阅5篇论文的施引文献，订阅后可以查看论文全部施引文献
1. Understanding the Regioselectivity and the Molecular Mechanism of [3 + 2] Cycloaddition Reactions between Nitrous Oxide and Conjugated Nitroalkenes: A DFT Computational Study;Molecules;2022-12-02
2. Mechanistic aspects of the synthesis of seven‐membered internal nitronates via stepwise [4 + 3] cycloaddition involving conjugated nitroalkenes: Molecular Electron Density Theory computational study;Journal of Computational Chemistry;2022-05-10
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