[(2R,3S,4R,5R)-5-(6-Aminopurine-1,3,7-Triium-9-Yl)-3,4-Dihydroxy-Tetrahydrofuran-2-Yl]Methoxy-N-[Hydroxy(Phosphonooxy)Phosphoryl]Phosphonamidic Acid

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Formula C10H17N6O12P3
IUPAC Name [(2r,3s,4r,5r)-5-(6-aminopurine-1,3,7-triium-9-yl)-3,4-dihydroxy-tetrahydrofuran-2-yl]methoxy-n-[hydroxy(phosphonooxy)phosphoryl]phosphonamidic acid
Molecular Mass 506.196 g·mol−1
Heat of Formation -2771.3 ± 16.7 kJ·mol−1
Dipole Moment 2.81 ± 1.08 D
Volume 478.72 Å 3
Surface Area 398.94 Å 2
HOMO Energy -9.14 ± 0.55 eV
LUMO Energy -1.18 ± eV
Point Group Symmetry C1
InChIKey ZOBDRNMANPOWOX-KQYNXXCUSA-O
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