2-Carboxy-6,7,8-Trihydroxy-5-(Hydroxymethyl)-5,6,7,8-Tetrahydro-1H-Imidazo[1,2-A]Pyridin-4-Ium

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Formula C9H3N2O6
IUPAC Name 2-carboxy-6,7,8-trihydroxy-5-(hydroxymethyl)-5,6,7,8-tetrahydro-1h-imidazo[1,2-a]pyridin-4-ium
Molecular Mass 235.130 g·mol−1
Heat of Formation 135.1 ± 16.7 kJ·mol−1
Dipole Moment 5.41 ± 1.08 D
Volume 214.94 Å 3
Surface Area 208.54 Å 2
HOMO Energy -10.82 ± 0.55 eV
LUMO Energy 0.41 ± eV
Point Group Symmetry Cs
InChIKey RYZHANTZYYFSGC-UHFFFAOYSA-O
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