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

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Formula C13H17NO7+
IUPAC Name (2s,3s,4s,5r,6s)-3,4,5-trihydroxy-6-(n-methylanilino)oxy-tetrahydropyran-2-carboxylic acid
Molecular Mass 299.277 g·mol−1
Heat of Formation -1042.8 ± 16.7 kJ·mol−1
Dipole Moment 2.06 ± 1.08 D
Volume 333.2 Å 3
Surface Area 297.47 Å 2
HOMO Energy -8.86 ± 0.55 eV
LUMO Energy 0.12 ± eV
Point Group Symmetry C1
InChIKey VACCKVAFFPKLAN-JPYZYGQNSA-N
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