Aryl Naphthoates: A Conformational Analysis Supported by Single-Crystal X-Ray Diffraction
Jorge L. Jios A E , Rudolf Wartchow B , Gustavo A. Echeverría C and Helmut Duddeck D
+ Author Affiliations
- Author Affiliations
A Unidad Plapimu-Laseisic (UNLP-CIC), Departamento de Química, Facultad de Ciencias Exactas, Universidad Nacional de La Plata, 47 esq. 115, (1900) La Plata, Argentina.
B Universität Hannover, Institut für Anorganische Chemie, Callinstr. 9, D-30167 Hannover, Germany.
C Departamento de Física, Facultad de Ciencias Exactas, Universidad Nacional de La Plata e IFLP (CONICET, CCT-La Plata), C. C. 67, 1900 La Plata, Argentina.
D Universität Hannover, Institut für Organische Chemie, Schneiderberg 1B, D-30167 Hannover, Germany.
E Corresponding author. Email: jljios@quimica.unlp.edu.ar
Australian Journal of Chemistry 69(3) 291-299 https://doi.org/10.1071/CH15071
Submitted: 10 February 2015 Accepted: 23 July 2015 Published: 27 August 2015
Abstract
The conformational study by X-ray diffraction of 12 aroyl esters of ortho-acetyl phenols is reported. The data are supported by theoretical calculations and described in terms of co-planarity, intramolecular steric interference, and intermolecular contacts. The observed hindrance was correlated with the C=O stretching vibration values in infrared spectroscopy.
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