1-(2-Deoxy-5-O-Phosphonatopentofuranosyl)-5-Fluoro-2,4(1H,3H)-Pyrimidinedione

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Formula C9H12FN2O8P++
IUPAC Name [(2r,3r,5s)-5-(5-fluoro-2,4-dioxo-pyrimidin-1-yl)-3-hydroxy-tetrahydrofuran-2-yl]methyl dihydrogen phosphate
Molecular Mass 326.172 g·mol−1
Heat of Formation -1869.5 ± 16.7 kJ·mol−1
Dipole Moment 5.84 ± 1.08 D
Volume 320.39 Å 3
Surface Area 294.88 Å 2
HOMO Energy -9.79 ± 0.55 eV
LUMO Energy -0.76 ± eV
Point Group Symmetry C1
InChIKey HFEKDTCAMMOLQP-QYNIQEEDSA-N
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