2-Amino-9-[5-O-(Hydroxy{[Hydroxy(Phosphonooxy)Phosphoryl]Oxy}Phosphoryl)-3-O-Methyl-D-Ribofuranosyl]-3,9-Dihydro-6H-Purin-6-One
Properties
| Property | Value |
|---|---|
| Formula | C11H18N5O14P3 |
| IUPAC Name | [[(2r,3s,4r,5r)-5-(2-amino-6-oxo-3h-purine-1,7-diium-4-id-9-yl)-4-hydroxy-3-methoxy-tetrahydrofuran-2-yl]methoxy-hydroxy-phosphoryl] phosphono hydrogen phosphate |
| Molecular Mass | 537.207 g·mol−1 |
| Heat of Formation | -3159.4 ± 16.7 kJ·mol−1 |
| Dipole Moment | 12.10 ± 1.08 D |
| Volume | 502.59 Å 3 |
| Surface Area | 387.03 Å 2 |
| HOMO Energy | -9.04 ± 0.55 eV |
| LUMO Energy | -1.51 ± eV |
| Point Group Symmetry | C1 |
| InChIKey | OHOBECDATGAGJW-KQYNXXCUSA-N |
| QR Code | Generate QR Code |
| Links | PubChem ChemSpider |
| DOI | |
| Downloads | Get JSON data Get MOL2 data Get SVG Image |
| Elements | P C H O N |