[[(2R,3S,5R)-5-(2,6-Diaminopurine-1,3,7-Triium-9-Yl)-3-Hydroxy-Tetrahydrofuran-2-Yl]Methoxy-Hydroxy-Phosphoryl] Phosphono Hydrogen Phosphate
Properties
| Property | Value |
|---|---|
| Formula | C10H17N6O12P3 |
| IUPAC Name | [[(2r,3s,5r)-5-(2,6-diaminopurine-1,3,7-triium-9-yl)-3-hydroxy-tetrahydrofuran-2-yl]methoxy-hydroxy-phosphoryl] phosphono hydrogen phosphate |
| Molecular Mass | 506.196 g·mol−1 |
| Heat of Formation | -2914.1 ± 16.7 kJ·mol−1 |
| Dipole Moment | 2.64 ± 1.08 D |
| Volume | 483.65 Å 3 |
| Surface Area | 377.47 Å 2 |
| HOMO Energy | -8.47 ± 0.55 eV |
| LUMO Energy | -1.49 ± eV |
| Point Group Symmetry | C1 |
| InChIKey | KKMSGOBSOMOQTJ-KVQBGUIXSA-O |
| 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 |