Computational study of the rotational pathways of the amino group in 2-chloroaniline, azines and formamide: One or two rotational barriers?
Author:
Publisher
Elsevier BV
Subject
Physical and Theoretical Chemistry,Condensed Matter Physics,Biochemistry
Reference22 articles.
1. Extended planarity and π delocalization in triazine base-derivatives;Fernández;Chem. Phys. Lett.,2006
2. Molecular modelling studies of side-chain rotation in substituted triazine rings;Birkett;J. Mol. Struct.,2002
3. The internal rotation and inversion pathways of the NH2 group in equatorial amino cyclobutane;Favero;J. Mol. Struct.,2002
4. Resonance interactions in acyclic systems. 3. Formamide internal rotation revisited. Charge and energy redistribution along the C–N bond rotational pathway;Wiberg;J. Am. Chem. Soc.,1992
5. Experimental 1H NMR and computational studies of internal rotation of solvated formamide;Taha;J. Phys. Chem. A,2000
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