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

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Formula C12H22N7O4P
IUPAC Name 2-[2-(2-amino-6-oxo-1h-purine-3,7-diium-9-yl)ethyl-(3-aminopropyl)amino]ethylphosphonic acid
Molecular Mass 359.321 g·mol−1
Heat of Formation -745.5 ± 16.7 kJ·mol−1
Dipole Moment 7.13 ± 1.08 D
Volume 419.87 Å 3
Surface Area 374.84 Å 2
HOMO Energy -8.96 ± 0.55 eV
LUMO Energy -0.48 ± eV
Point Group Symmetry C1
InChIKey IBZPLGNOGQELPO-UHFFFAOYSA-P
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