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ESR spectroscopy of the 4,5-bis(methoxycarbonyl)-1,3,2-dithiazol-2-yl radical labelled with sulphur-33 and nitrogen-15

✍ Scribed by Keith F. Preston; John P. B. Sandall; Leslie H. Sutcliffe


Publisher
John Wiley and Sons
Year
1988
Tongue
English
Weight
449 KB
Volume
26
Category
Article
ISSN
0749-1581

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✦ Synopsis


A derivative of the 1,3,2dlthiazol-2-yl radical was labelled with 33S in order to evaluate the p spin densities on the sulphur atoms. This information is required to provide a full description of the SOMO which, in turn, aids the understanding of the structure of the radical dimers. An unexpected result is that the two sulphur atoms are nowquivalent in the solid state. Calculations suggest that this is due to out-of-plane twisting of the substitwnt groups. Comparison of the ESR parameters of the bis(methoxycarbony1) derivative with other members of the 1,3,2dithiazol-2-y1 group of radicals (including the parent radical) shows that it is a good model for the whole group