[(2R,3S,4R,5R)-3,4-Dihydroxy-5-(6-Oxo-1H-Purine-3,7-Diium-9-Yl)Tetrahydrofuran-2-Yl]Methyl Phosphono Hydrogen Phosphate

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Formula C10H14N4O11P2
IUPAC Name [(2r,3s,4r,5r)-3,4-dihydroxy-5-(6-oxo-1h-purine-3,7-diium-9-yl)tetrahydrofuran-2-yl]methyl phosphono hydrogen phosphate
Molecular Mass 428.186 g·mol−1
Heat of Formation -2353.5 ± 16.7 kJ·mol−1
Dipole Moment 5.38 ± 1.08 D
Volume 407.06 Å 3
Surface Area 351.45 Å 2
HOMO Energy -9.60 ± 0.55 eV
LUMO Energy -1.81 ± eV
Point Group Symmetry C1
InChIKey DGRLHDWMQVZZIF-KQYNXXCUSA-P
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