[(2E)-1-Methyl-3-(2,4,6-Trichlorophenyl)-2-Triazen-1-Yl]Methyl β-D-Glucopyranosiduronic Acid

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Formula C14H16Cl3N3O7
IUPAC Name (2s,3s,4r,5r,6r)-3,4,5-trihydroxy-6-[[methyl-[(e)-(2,4,6-trichlorophenyl)azo]amino]methoxy]tetrahydropyran-2-carboxylic acid
Molecular Mass 444.652 g·mol−1
Heat of Formation -1129.9 ± 16.7 kJ·mol−1
Dipole Moment 4.27 ± 1.08 D
Volume 445.13 Å 3
Surface Area 362.45 Å 2
HOMO Energy -9.51 ± 0.55 eV
LUMO Energy 1.82 ± eV
Point Group Symmetry C1
InChIKey YTMCIHZHJQPZNT-QUWWKDIESA-N
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Elements H C N O Cl