5'-O-[({3-[5-(2-Fluorophenyl)-1,2,4-Oxadiazol-3-Yl]Benzoyl}Oxy)(Hydroxy)Phosphoryl]Adenosine

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Formula C25H21FN7O9P
IUPAC Name [[(2r,3s,4r,5r)-5-(6-aminopurin-9-yl)-3,4-dihydroxyoxolan-2-yl]methoxy-hydroxyphosphoryl] 3-[5-(2-fluorophenyl)-1,2,4-oxadiazol-3-yl]benzoate
Molecular Mass 613.448 g·mol−1
Heat of Formation -1407.1 ± 16.7 kJ·mol−1
Dipole Moment 6.15 ± 1.08 D
Volume 636.56 Å 3
Surface Area 434.45 Å 2
HOMO Energy -9.13 ± 0.55 eV
LUMO Energy -1.68 ± eV
Point Group Symmetry C1
InChIKey XGTSAMZIYGBAIU-VEBYGKHWSA-N
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