[[(2R,3S,4R,5R)-3,4-Dihydroxy-5-(6-Hydroxypurine-1,3,7-Triium-9-Yl)Tetrahydrofuran-2-Yl]Methoxy-Hydroxy-Phosphoryl] Phosphono Hydrogen Phosphate
Properties
| Property | Value |
|---|---|
| Formula | C10H16N4O14P3 |
| IUPAC Name | [[(2r,3s,4r,5r)-3,4-dihydroxy-5-(6-hydroxypurine-1,3,7-triium-9-yl)tetrahydrofuran-2-yl]methoxy-hydroxy-phosphoryl] phosphono hydrogen phosphate |
| Molecular Mass | 509.174 g·mol−1 |
| Heat of Formation | -3209.3 ± 16.7 kJ·mol−1 |
| Dipole Moment | 6.12 ± 1.08 D |
| Volume | 470.22 Å 3 |
| Surface Area | 394.41 Å 2 |
| HOMO Energy | -9.91 ± 0.55 eV |
| LUMO Energy | -1.44 ± eV |
| Point Group Symmetry | C1 |
| InChIKey | COYYFPFIOQTMIV-KQYNXXCUSA-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 |