Methyl (2S)-2-[[[(2S,5R)-5-(6-Aminopurine-1,3,7-Triium-9-Yl)-2,5-Dihydrofuran-2-Yl]Methoxy-Phenoxy-Phosphoryl]Amino]Propanoate

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Formula C20H23N6O6P
IUPAC Name methyl (2s)-2-[[[(2s,5r)-5-(6-aminopurine-1,3,7-triium-9-yl)-2,5-dihydrofuran-2-yl]methoxy-phenoxy-phosphoryl]amino]propanoate
Molecular Mass 474.407 g·mol−1
Heat of Formation -869.4 ± 16.7 kJ·mol−1
Dipole Moment 4.41 ± 1.08 D
Volume 528.11 Å 3
Surface Area 372.5 Å 2
HOMO Energy -8.57 ± 0.55 eV
LUMO Energy 2.47 ± eV
Point Group Symmetry C1
InChIKey JOLZGVRCVIDVDC-CJCZPYSJSA-O
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