5'-O-[({[(S)-Chloro(Fluoro)Phosphonomethyl](Hydroxy)Phosphoryl}Oxy)(Hydroxy)Phosphoryl]-2'-Deoxyguanosine

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Properties Simple | Detailed

Formula C11H17ClFN5O12P3
IUPAC Name [(s)-[[[(2r,3s,5r)-5-(2-amino-6-oxo-3h-purine-1,7-diium-4-id-9-yl)-3-hydroxy-tetrahydrofuran-2-yl]methoxy-hydroxy-phosphoryl]oxy-hydroxy-phosphoryl]-chloro-fluoro-methyl]phosphonic acid
Molecular Mass 558.652 g·mol−1
Heat of Formation -2937.0 ± 16.7 kJ·mol−1
Dipole Moment 15.14 ± 1.08 D
Volume 520.78 Å 3
Surface Area 385.87 Å 2
HOMO Energy -8.89 ± 0.55 eV
LUMO Energy -2.12 ± eV
Point Group Symmetry C1
InChIKey YYWHXOYNXRQZKR-XUSYNCDOSA-N
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Elements C F H Cl O N P