Issue 6, 1977

Ground states of molecules. Part 35. MINDO/3 study of the Cornforth rearrangement

Abstract

MINDO/3 calculations are reported for the Cornforth rearrangement of 5-methoxyoxazole-4-carboxamide and of the 2-vinyl derivative to the corresponding methyl 5-amino-oxazole-4-carboxylates. The reaction involves an unusual intermediate for which no satisfactory classical structure can be written. The results account well for the experimental evidence concerning such reactions.

Article information

Article type
Paper

J. Chem. Soc., Perkin Trans. 2, 1977, 724-729

Ground states of molecules. Part 35. MINDO/3 study of the Cornforth rearrangement

M. J. S. Dewar and I. J. Turchi, J. Chem. Soc., Perkin Trans. 2, 1977, 724 DOI: 10.1039/P29770000724

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