2-(6-Aminopurine-1,7,9-Triium-3-Yl)Ethanol

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Formula C7H9N5O
IUPAC Name 2-(6-aminopurine-1,7,9-triium-3-yl)ethanol
Molecular Mass 179.179 g·mol−1
Heat of Formation 116.1 ± 16.7 kJ·mol−1
Dipole Moment 4.22 ± 1.08 D
Volume 202.64 Å 3
Surface Area 197.18 Å 2
HOMO Energy -8.74 ± 0.55 eV
LUMO Energy 2.17 ± eV
Point Group Symmetry C1
InChIKey BKXDSFUWBALNEF-UHFFFAOYSA-O
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