Homoanomeric effect in the 1,2-dimethoxyethyl radical

Henry, D, Beckwith, A and Radom, L 2003, 'Homoanomeric effect in the 1,2-dimethoxyethyl radical', Australian Journal of Chemistry, vol. 56, no. 5, pp. 429-436.


Document type: Journal Article
Collection: Journal Articles

Title Homoanomeric effect in the 1,2-dimethoxyethyl radical
Author(s) Henry, D
Beckwith, A
Radom, L
Year 2003
Journal name Australian Journal of Chemistry
Volume number 56
Issue number 5
Start page 429
End page 436
Total pages 8
Publisher CSIRO Publishing
Abstract A homoanomeric effect is found to stabilize the 1,2-dimethoxyethyl radical (CH3O-CH-CH2OCH3) in a conformation in which the singly-occupied orbital at the radical centre is approximately coplanar with the p-type lone pair on the a-oxygen and with the ß-C-O bond. The magnitude of this stabilization is predicted to be ~10-12 kJ mol-1 at the G3(MP2)-RAD and CBS-RAD levels of theory.
Subject Structural Chemistry and Spectroscopy
Theory and Design of Materials
DOI - identifier 10.1071/CH02255
Copyright notice © CSIRO 2003
ISSN 0004-9425
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