[[(2R,3S,4R,5R)-5-(6-Aminopurin-9-Yl)-3,4-Dihydroxy-Tetrahydrofuran-2-Yl]Methoxy-Hydroxy-Phosphoryl] [(2R,3R,4R,5R)-5-(3-Carbamoylpyridin-1-Ium-1-Yl)-4-Fluoro-3-Hydroxy-Tetrahydrofuran-2-Yl]Methyl Phosphate
Properties
| Property | Value |
|---|---|
| Formula | C21H26FN7O13P2 |
| IUPAC Name | [[(2r,3s,4r,5r)-5-(6-aminopurin-9-yl)-3,4-dihydroxy-tetrahydrofuran-2-yl]methoxy-hydroxy-phosphoryl] [(2r,3r,4r,5r)-5-(3-carbamoylpyridin-1-ium-1-yl)-4-fluoro-3-hydroxy-tetrahydrofuran-2-yl]methyl phosphate |
| Molecular Mass | 665.416 g·mol−1 |
| Heat of Formation | -2689.9 ± 16.7 kJ·mol−1 |
| Dipole Moment | 7.85 ± 1.08 D |
| Volume | 662.41 Å 3 |
| Surface Area | 434.38 Å 2 |
| HOMO Energy | -9.06 ± 0.55 eV |
| LUMO Energy | -2.03 ± eV |
| Point Group Symmetry | C1 |
| InChIKey | JSGNSBZQCQQLEF-OZCXFSBSSA-N |
| QR Code | Generate QR Code |
| Links | PubChem ChemSpider |
| DOI | |
| Downloads | Get JSON data Get MOL2 data Get SVG Image |
| Elements | C F H O N P |