3-(2-Amino-6-Oxo-1,6-Dihydro-9H-Purin-9-Yl)-L-Alanine

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Properties Simple | Detailed

Formula C8H10N6O3
IUPAC Name (2s)-2-amino-3-(2-amino-6-oxo-1h-purine-3,7-diium-9-yl)propanoic acid
Molecular Mass 238.203 g·mol−1
Heat of Formation -274.6 ± 16.7 kJ·mol−1
Dipole Moment 6.74 ± 1.08 D
Volume 255.66 Å 3
Surface Area 241.8 Å 2
HOMO Energy -8.89 ± 0.55 eV
LUMO Energy -0.43 ± eV
Point Group Symmetry C1
InChIKey BYXRWAYRLQEIRT-GSVOUGTGSA-N
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