[(3R)-3-[(2-Amino-6-Oxo-3H-Purine-1,7-Diium-4-Id-9-Yl)Methoxy]-4-Hydroxy-Butyl]Phosphonic Acid

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Formula C10H17N5O6P
IUPAC Name [(3r)-3-[(2-amino-6-oxo-3h-purine-1,7-diium-4-id-9-yl)methoxy]-4-hydroxy-butyl]phosphonic acid
Molecular Mass 334.246 g·mol−1
Heat of Formation -1112.1 ± 16.7 kJ·mol−1
Dipole Moment 12.72 ± 1.08 D
Volume 355.1 Å 3
Surface Area 300.0 Å 2
HOMO Energy -8.96 ± 0.55 eV
LUMO Energy -0.30 ± eV
Point Group Symmetry C1
InChIKey MBZDEIZUVFGEEI-ZCFIWIBFSA-P
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