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

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Properties Simple | Detailed

Formula C10H15N4O11P2
IUPAC Name [(2s,3r,4r,5r)-3,4-dihydroxy-5-(6-oxo-3h-purine-1,7-diium-4-id-9-yl)tetrahydrofuran-2-yl]methyl phosphono hydrogen phosphate
Molecular Mass 429.194 g·mol−1
Heat of Formation -2304.5 ± 16.7 kJ·mol−1
Dipole Moment 15.79 ± 1.08 D
Volume 413.75 Å 3
Surface Area 354.92 Å 2
HOMO Energy -8.99 ± 0.55 eV
LUMO Energy -1.72 ± eV
Point Group Symmetry C1
InChIKey DGRLHDWMQVZZIF-FCIPNVEPSA-P
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