1-(5-O-Phosphono-D-Ribofuranosyl)-1,2-Dihydro-4H-Pyrazolo[3,4-D]Pyrimidin-4-One

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Formula C10H13N4O8P
IUPAC Name [(2r,3s,4r,5r)-3,4-dihydroxy-5-(4-oxo-2h-pyrazolo[3,4-d]pyrimidin-1-yl)tetrahydrofuran-2-yl]methyl dihydrogen phosphate
Molecular Mass 348.206 g·mol−1
Heat of Formation -1347.5 ± 16.7 kJ·mol−1
Dipole Moment 12.47 ± 1.08 D
Volume 348.37 Å 3
Surface Area 303.14 Å 2
HOMO Energy -9.16 ± 0.55 eV
LUMO Energy 1.78 ± eV
Point Group Symmetry C1
InChIKey HTHXSXRMCTWBOC-DAGMQNCNSA-N
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