2'-Deoxy-5-Fluorocytidine 5'-(Dihydrogen Phosphate)

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Properties Simple | Detailed

Formula C9H13FN3O7P
IUPAC Name [(2r,3r,5s)-5-(4-amino-5-fluoro-2-oxo-pyrimidin-1-yl)-3-hydroxy-tetrahydrofuran-2-yl]methyl dihydrogen phosphate
Molecular Mass 325.188 g·mol−1
Heat of Formation -1622.6 ± 16.7 kJ·mol−1
Dipole Moment 3.75 ± 1.08 D
Volume 322.1 Å 3
Surface Area 300.36 Å 2
HOMO Energy -9.45 ± 0.55 eV
LUMO Energy -0.62 ± eV
Point Group Symmetry C1
InChIKey OPBLKWSMVCXQNV-QYNIQEEDSA-N
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Elements C F H O N P