[(1R,2R,4R,6R,7S)-2-(2,4-Dioxopyrimidin-1-Yl)-6-Fluoro-7-Hydroxy-3-Oxabicyclo[2.2.1]Heptan-4-Yl]Methyl Dihydrogen Phosphate

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Properties Simple | Detailed

Formula C11H14FN2O8P
IUPAC Name [(1r,2r,4r,6r,7s)-2-(2,4-dioxopyrimidin-1-yl)-6-fluoro-7-hydroxy-3-oxabicyclo[2.2.1]heptan-4-yl]methyl dihydrogen phosphate
Molecular Mass 352.210 g·mol−1
Heat of Formation -1855.5 ± 16.7 kJ·mol−1
Dipole Moment 4.68 ± 1.08 D
Volume 347.05 Å 3
Surface Area 294.3 Å 2
HOMO Energy -10.02 ± 0.55 eV
LUMO Energy -0.67 ± eV
Point Group Symmetry C1
InChIKey INQRQYVGAIORTC-QVPLNXPXSA-N
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Elements C F H O N P