[2-[(2-Amino-6-Oxo-3H-Purine-1,7-Diium-4-Id-9-Yl)Methoxy]Ethoxy-Hydroxy-Phosphoryl]Oxy-[[(1R)-2-(6-Aminopurine-1,3,7-Triium-9-Yl)-1-Methyl-Ethoxy]Methyl]Phosphinic Acid

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Properties Simple | Detailed

Formula C17H26N10O9P2+
IUPAC Name [2-[(2-amino-6-oxo-3h-purine-1,7-diium-4-id-9-yl)methoxy]ethoxy-hydroxy-phosphoryl]oxy-[[(1r)-2-(6-aminopurine-1,3,7-triium-9-yl)-1-methyl-ethoxy]methyl]phosphinic acid
Molecular Mass 576.398 g·mol−1
Heat of Formation -1673.8 ± 16.7 kJ·mol−1
Dipole Moment 9.31 ± 1.08 D
Volume 595.0 Å 3
Surface Area 422.08 Å 2
HOMO Energy -8.77 ± 0.55 eV
LUMO Energy -1.29 ± eV
Point Group Symmetry C1
InChIKey NAHVDOXNBQYKFB-SNVBAGLBSA-Q
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