(2S)-3-(6-Aminopurine-1,3,7-Triium-9-Yl)-2-Hydroxy-Propanoic Acid

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Properties Simple | Detailed

Formula C8H9N5O3
IUPAC Name (2s)-3-(6-aminopurine-1,3,7-triium-9-yl)-2-hydroxy-propanoic acid
Molecular Mass 223.189 g·mol−1
Heat of Formation -286.0 ± 16.7 kJ·mol−1
Dipole Moment 1.21 ± 1.08 D
Volume 240.99 Å 3
Surface Area 230.09 Å 2
HOMO Energy -9.00 ± 0.55 eV
LUMO Energy 2.54 ± eV
Point Group Symmetry C1
InChIKey ZVXNQOAPSWEMAB-BYPYZUCNSA-O
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