(2S)-2-Amino-4-(2-Amino-6-Oxo-1H-Purine-3,7-Diium-9-Yl)Butanoic Acid

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Properties Simple | Detailed

Formula C9H12N6O3
IUPAC Name (2s)-2-amino-4-(2-amino-6-oxo-1h-purine-3,7-diium-9-yl)butanoic acid
Molecular Mass 252.230 g·mol−1
Heat of Formation -311.3 ± 16.7 kJ·mol−1
Dipole Moment 6.14 ± 1.08 D
Volume 280.94 Å 3
Surface Area 266.85 Å 2
HOMO Energy -9.03 ± 0.55 eV
LUMO Energy -0.54 ± eV
Point Group Symmetry C1
InChIKey QDVKCMKNMIGEDS-BYPYZUCNSA-P
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