1-O-[Methyl(Phenyl)Amino]-D-Glucopyranuronic Acid

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Formula C13H17NO7+
IUPAC Name (2s,3r,4r,5s,6r)-3,4,5-trihydroxy-6-(n-methylanilino)oxy-tetrahydropyran-2-carboxylic acid
Molecular Mass 299.277 g·mol−1
Heat of Formation -1085.7 ± 16.7 kJ·mol−1
Dipole Moment 4.96 ± 1.08 D
Volume 328.38 Å 3
Surface Area 284.41 Å 2
HOMO Energy -9.41 ± 0.55 eV
LUMO Energy -0.39 ± eV
Point Group Symmetry C1
InChIKey VACCKVAFFPKLAN-CFDXXZMTSA-N
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