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

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Properties Simple | Detailed

Formula C10H14FN4O8P+
IUPAC Name [(2s,3r,4r,5r)-5-(2-fluoro-6-oxo-3h-purine-1,7-diium-4-id-9-yl)-3,4-dihydroxy-tetrahydrofuran-2-yl]methyl dihydrogen phosphate
Molecular Mass 368.212 g·mol−1
Heat of Formation -1607.9 ± 16.7 kJ·mol−1
Dipole Moment 11.15 ± 1.08 D
Volume 359.21 Å 3
Surface Area 320.59 Å 2
HOMO Energy -9.47 ± 0.55 eV
LUMO Energy 2.43 ± eV
Point Group Symmetry C1
InChIKey SNSXXRHDCNZVEL-BZKDHIKHSA-P
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