[[(2R,3S,4R,5R)-5-(2-Amino-8-Bromo-Purine-1,3,7-Triium-9-Yl)-3,4-Dihydroxy-Tetrahydrofuran-2-Yl]Methoxy-Hydroxy-Phosphoryl] Phosphono Hydrogen Phosphate
Properties
| Property | Value |
|---|---|
| Formula | C10H15BrN5O13P3 |
| IUPAC Name | [[(2r,3s,4r,5r)-5-(2-amino-8-bromo-purine-1,3,7-triium-9-yl)-3,4-dihydroxy-tetrahydrofuran-2-yl]methoxy-hydroxy-phosphoryl] phosphono hydrogen phosphate |
| Molecular Mass | 586.077 g·mol−1 |
| Heat of Formation | -3059.1 ± 16.7 kJ·mol−1 |
| Dipole Moment | 7.13 ± 1.08 D |
| Volume | 504.06 Å 3 |
| Surface Area | 385.92 Å 2 |
| HOMO Energy | -8.88 ± 0.55 eV |
| LUMO Energy | -2.14 ± eV |
| Point Group Symmetry | C1 |
| InChIKey | UWPIYTYHEWNFBT-UAKXSSHOSA-O |
| QR Code | Generate QR Code |
| Links | |
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| Downloads | Get JSON data Get MOL2 data Get SVG Image |
| Elements | C H O N P Br |