[2-[(3S)-3-(2-Amino-6-Oxo-1H-Purine-3,7-Diium-9-Yl)Pyrrolidin-1-Yl]-2-Oxo-Ethyl]Phosphonic Acid

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Formula C11H15N6O5P
IUPAC Name [2-[(3s)-3-(2-amino-6-oxo-1h-purine-3,7-diium-9-yl)pyrrolidin-1-yl]-2-oxo-ethyl]phosphonic acid
Molecular Mass 342.248 g·mol−1
Heat of Formation -921.9 ± 16.7 kJ·mol−1
Dipole Moment 8.03 ± 1.08 D
Volume 363.87 Å 3
Surface Area 321.33 Å 2
HOMO Energy -8.93 ± 0.55 eV
LUMO Energy 2.55 ± eV
Point Group Symmetry C1
InChIKey AXWGCVBWJKHTCJ-LURJTMIESA-P
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