1-{3-Deoxy-5-O-[(S)-Hydroxy{[(R)-Hydroxy(Phosphonooxy)Phosphoryl]Oxy}Phosphoryl]-β-D-Erythro-Pentofuranosyl}-2-Hydroxy-2,3-Dihydro-4(1H)-Pyrimidinone
Properties
| Property | Value |
|---|---|
| Formula | C9H17N2O14P3 |
| IUPAC Name | dihydroxyphosphoryl [hydroxy-[[(2s,4r,5r)-4-hydroxy-5-[(2s)-2-hydroxy-6-oxo-1,2-dihydropyrimidin-3-yl]tetrahydrofuran-2-yl]methoxy]phosphoryl] hydrogen phosphate |
| Molecular Mass | 470.158 g·mol−1 |
| Heat of Formation | -3477.6 ± 16.7 kJ·mol−1 |
| Dipole Moment | 4.98 ± 1.08 D |
| Volume | 446.11 Å 3 |
| Surface Area | 354.29 Å 2 |
| HOMO Energy | -9.21 ± 0.55 eV |
| LUMO Energy | -1.89 ± eV |
| Point Group Symmetry | C1 |
| InChIKey | CVEDUOUYNXHQBA-HIORRCEOSA-N |
| QR Code | Generate QR Code |
| Links | ChemSpider |
| DOI | |
| Downloads | Get JSON data Get MOL2 data Get SVG Image |
| Elements | P C H O N |