Issue 12, 1987

Ab initio LCAO-MO calculations on α-D-glucopyranose, β-D-fructopyranose, and their thiopyranoid-ring analogues. Application to a theory of sweetness

Abstract

Ab initio SCF LCAO-MO calculations at the STO-3G level have been performed on the title compounds and the results are discussed in terms of net atomic charges and Mulliken population analysis, with a view to providing an explanation for the greater sweetness observed in the case of the thio analogues.

Article information

Article type
Paper

J. Chem. Soc., Chem. Commun., 1987, 937-939

Ab initio LCAO-MO calculations on α-D-glucopyranose, β-D-fructopyranose, and their thiopyranoid-ring analogues. Application to a theory of sweetness

R. J. Woods, V. H. Smith, W. A. Szarek and A. Farazdel, J. Chem. Soc., Chem. Commun., 1987, 937 DOI: 10.1039/C39870000937

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