Methyl N-[{[3-(6-Amino-9H-Purin-9-Yl)-4-Fluoro-5-Hydroxy-2-Methylenecyclopentyl]Methoxy}(Phenoxy)Phosphoryl]-L-Alaninate

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Properties Simple | Detailed

Formula C22H9FN6O6P
IUPAC Name methyl n-[{[3-(6-amino-9h-purin-9-yl)-4-fluoro-5-hydroxy-2-methylenecyclopentyl]methoxy}(phenoxy)phosphoryl]-l-alaninate
Molecular Mass 503.316 g·mol−1
Heat of Formation 1332.3 ± 16.7 kJ·mol−1
Dipole Moment 21.55 ± 1.08 D
Volume 487.83 Å 3
Surface Area 408.22 Å 2
HOMO Energy -8.41 ± 0.55 eV
LUMO Energy -4.21 ± eV
Point Group Symmetry C1
InChIKey POBLQHUCZZQDHY-CMYUAGGPSA-N
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