[[(2S,3R,5R)-5-(2-Amino-4-Oxo-1,6-Dihydropyrrolo[2,3-D]Pyrimidine-3,7-Diium-6-Ylium-7-Yl)-3-Hydroxy-Tetrahydrofuran-2-Yl]Methoxy-Hydroxy-Phosphoryl] Phosphono Hydrogen Phosphate
Properties
| Property | Value |
|---|---|
| Formula | C11H18N4O13P3+ |
| IUPAC Name | [[(2s,3r,5r)-5-(2-amino-4-oxo-1,6-dihydropyrrolo[2,3-d]pyrimidine-3,7-diium-6-ylium-7-yl)-3-hydroxy-tetrahydrofuran-2-yl]methoxy-hydroxy-phosphoryl] phosphono hydrogen phosphate |
| Molecular Mass | 507.201 g·mol−1 |
| Heat of Formation | -3070.9 ± 16.7 kJ·mol−1 |
| Dipole Moment | 11.34 ± 1.08 D |
| Volume | 481.85 Å 3 |
| Surface Area | 396.46 Å 2 |
| HOMO Energy | -8.78 ± 0.55 eV |
| LUMO Energy | -1.96 ± eV |
| Point Group Symmetry | C1 |
| InChIKey | DWNAUZLVZDLJJN-GJMOJQLCSA-P |
| QR Code | Generate QR Code |
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| Downloads | Get JSON data Get MOL2 data Get SVG Image |
| Elements | P C H O N |