O-{[(2R,3S,4R,5R)-5-(2,4-Dioxo-3,4-Dihydro-1(2H)-Pyrimidinyl)-3,4-Dihydroxytetrahydro-2-Furanyl]Methyl} O-[(2R,3R,4S,5S,6R)-3,4,5-Trihydroxy-6-(Hydroxymethyl)Tetrahydro-2H-Pyran-2-Yl] Dihydrogen Thiodiphosphate

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Formula C15H24N2O16P2S
IUPAC Name [[(2r,3s,4r,5r)-5-(2,4-dioxopyrimidin-1-yl)-3,4-dihydroxy-tetrahydrofuran-2-yl]methoxy-hydroxy-phosphinothioyl] [(2r,3r,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydropyran-2-yl] hydrogen phosphate
Molecular Mass 582.367 g·mol−1
Heat of Formation -2078.9 ± 16.7 kJ·mol−1
Dipole Moment 3.99 ± 1.08 D
Volume 511.46 Å 3
Surface Area 382.57 Å 2
HOMO Energy -9.84 ± 0.55 eV
LUMO Energy -2.41 ± eV
Point Group Symmetry C1
InChIKey BMUHJFFEKGVRCZ-JYYUFJJHSA-N
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