Methyl (2S)-2-[[[(1S,2Z)-2-[(2,6-Diaminopurine-1,3,7-Triium-9-Yl)Methylene]Cyclopropyl]Methoxy-Phenoxy-Phosphoryl]Amino]Propanoate

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Formula C20H24N7O5P
IUPAC Name methyl (2s)-2-[[[(1s,2z)-2-[(2,6-diaminopurine-1,3,7-triium-9-yl)methylene]cyclopropyl]methoxy-phenoxy-phosphoryl]amino]propanoate
Molecular Mass 473.422 g·mol−1
Heat of Formation -614.8 ± 16.7 kJ·mol−1
Dipole Moment 1.85 ± 1.08 D
Volume 537.91 Å 3
Surface Area 405.35 Å 2
HOMO Energy -8.34 ± 0.55 eV
LUMO Energy -0.61 ± eV
Point Group Symmetry C1
InChIKey MZBSYZXMECHWSH-DAJRRLBVSA-O
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