[(2S,3S,5R)-5-(2-Amino-6-Oxo-1H-Purine-3,7-Diium-9-Yl)-3-Hydroxy-Tetrahydrofuran-2-Yl]Methylsulfanylphosphonic Acid

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Formula C10H14N5O6PS
IUPAC Name [(2s,3s,5r)-5-(2-amino-6-oxo-1h-purine-3,7-diium-9-yl)-3-hydroxy-tetrahydrofuran-2-yl]methylsulfanylphosphonic acid
Molecular Mass 363.287 g·mol−1
Heat of Formation -1112.2 ± 16.7 kJ·mol−1
Dipole Moment 7.09 ± 1.08 D
Volume 368.66 Å 3
Surface Area 329.18 Å 2
HOMO Energy -8.97 ± 0.55 eV
LUMO Energy -0.59 ± eV
Point Group Symmetry C1
InChIKey ZJOZCUDKDVFPJU-KVQBGUIXSA-P
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