Methyl (2S)-2-[[[(1S,2Z)-2-[(2,6-Diaminopurine-1,3,7-Triium-9-Yl)Methylene]Cyclopropyl]Methoxy-Phenoxy-Phosphoryl]Amino]Propanoate
Properties
Property | Value |
---|---|
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 |
QR Code | Generate QR Code |
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Elements | P C H O N |