2-[5-O-(Hydroxy{[Hydroxy(Phosphonooxy)Phosphoryl]Oxy}Phosphoryl)-β-D-Ribofuranosyl]-1,2,4-Triazine-3,5(2H,4H)-Dione
Properties
| Property | Value |
|---|---|
| Formula | C8H14N3O15P3 |
| IUPAC Name | [[(2r,3s,4r,5r)-5-(3,5-dioxo-1,2,4-triazin-2-yl)-3,4-dihydroxy-tetrahydrofuran-2-yl]methoxy-hydroxy-phosphoryl] phosphono hydrogen phosphate |
| Molecular Mass | 485.129 g·mol−1 |
| Heat of Formation | -3529.8 ± 16.7 kJ·mol−1 |
| Dipole Moment | 2.53 ± 1.08 D |
| Volume | 437.29 Å 3 |
| Surface Area | 346.71 Å 2 |
| HOMO Energy | -9.73 ± 0.55 eV |
| LUMO Energy | -1.55 ± eV |
| Point Group Symmetry | C1 |
| InChIKey | NCKFQXVRKKNRBB-SHUUEZRQSA-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 |