2-(6-Aminopurine-1,3,7-Triium-9-Yl)Ethoxymethyl-[Hydroxy(Phosphonooxy)Phosphoryl]Oxy-Phosphinic Acid

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Formula C8H14N5O10P3
IUPAC Name 2-(6-aminopurine-1,3,7-triium-9-yl)ethoxymethyl-[hydroxy(phosphonooxy)phosphoryl]oxy-phosphinic acid
Molecular Mass 433.146 g·mol−1
Heat of Formation -2470.2 ± 16.7 kJ·mol−1
Dipole Moment 6.45 ± 1.08 D
Volume 405.46 Å 3
Surface Area 329.1 Å 2
HOMO Energy -9.20 ± 0.55 eV
LUMO Energy 1.63 ± eV
Point Group Symmetry C1
InChIKey MNUPAGMJNJBMNR-UHFFFAOYSA-O
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