[[(1S,2S,4S,5R)-2-(6-Aminopurine-1,3,7-Triium-9-Yl)-4-Hydroxy-5-Bicyclo[3.1.0]Hexanyl]Methoxy-Hydroxy-Phosphoryl] Phosphono Hydrogen Phosphate
Properties
| Property | Value |
|---|---|
| Formula | C12H18N5O11P3 |
| IUPAC Name | [[(1s,2s,4s,5r)-2-(6-aminopurine-1,3,7-triium-9-yl)-4-hydroxy-5-bicyclo[3.1.0]hexanyl]methoxy-hydroxy-phosphoryl] phosphono hydrogen phosphate |
| Molecular Mass | 501.219 g·mol−1 |
| Heat of Formation | -2580.2 ± 16.7 kJ·mol−1 |
| Dipole Moment | 3.88 ± 1.08 D |
| Volume | 490.79 Å 3 |
| Surface Area | 400.63 Å 2 |
| HOMO Energy | -9.03 ± 0.55 eV |
| LUMO Energy | -1.88 ± eV |
| Point Group Symmetry | C1 |
| InChIKey | DFAVNLHIKNQEIL-VXDIOVFMSA-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 |