(1R,2S,3R,5R)-3-(4-Amino-1H-Imidazo[4,5-C]Pyridin-1-Yl)-5-(Hydroxymethyl)-1,2-Cyclopentanediol

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Formula C12H16N4O3
IUPAC Name (1s,2r,3r,5s)-3-(4-aminoimidazo[4,5-c]pyridin-1-ium-1-yl)-5-(hydroxymethyl)cyclopentane-1,2-diol
Molecular Mass 264.280 g·mol−1
Heat of Formation -352.0 ± 16.7 kJ·mol−1
Dipole Moment 3.22 ± 1.08 D
Volume 298.43 Å 3
Surface Area 267.16 Å 2
HOMO Energy -8.41 ± 0.55 eV
LUMO Energy -0.17 ± eV
Point Group Symmetry C1
InChIKey XNJHAZWZQGXOSC-BLMCLJNJSA-N
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