The Polar Mechanism for the Nitration of Benzene with Nitronium Ion: Ab Initio Structures of Intermediates and Transition States
Author:
Affiliation:
1. Department of Chemistry and Biochemistry, Utah State University, Logan, Utah 84322-0300, United States
2. Department of Chemistry, University of Liverpool, Liverpool L69 7ZD, United Kingdom
Publisher
American Chemical Society (ACS)
Subject
Organic Chemistry
Link
https://pubs.acs.org/doi/pdf/10.1021/jo401775u
Reference29 articles.
1. Charge-Transfer Mechanism for Electrophilic Aromatic Nitration and Nitrosation via the Convergence of (ab Initio) Molecular-Orbital and Marcus−Hush Theories with Experiments
2. Unified Mechanistic Concept of Electrophilic Aromatic Nitration: Convergence of Computational Results and Experimental Data
3. Electrophilic Aromatic Nitration: Understanding Its Mechanism and Substituent Effects
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