QTAIM interpretation of the basicity of substituted anilines
Author:
Publisher
Elsevier BV
Subject
Physical and Theoretical Chemistry,General Physics and Astronomy
Reference19 articles.
1. Ring Versus Nitrogen Protonation of Anilines
2. New Density Functional and Atoms in Molecules Method of Computing Relative pKa Values in Solution
3. Comparison of different atomic charge schemes for predicting pKa variations in substituted anilines and phenols
4. Substituent effects on the physical properties and pKa of phenol
5. Estimation of pKa Using Quantum Topological Molecular Similarity Descriptors: Application to Carboxylic Acids, Anilines and Phenols
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3. Understanding the fragmentation mechanisms of methoxy-, mesyl-, and tosyl-lapachol derivatives by computational chemistry and mass spectrometry analysis;International Journal of Mass Spectrometry;2017-07
4. Microwaves and Aqueous Solvents Promote the Reaction of Poorly Nucleophilic Anilines with a Zincke Salt;The Journal of Organic Chemistry;2016-03-30
5. The DFT calculations of pKa values of the cationic acids of aniline and pyridine derivatives in common solvents;Acta Chimica Slovaca;2014-04-01
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