[[(2R,3S,4R,5R)-5-(4-Amino-2-Oxo-Pyrimidin-3-Ium-1-Yl)-4-Azido-3-Hydroxy-Tetrahydrofuran-2-Yl]Methoxy-Hydroxy-Phosphoryl] Phosphono Hydrogen Phosphate
Properties
| Property | Value |
|---|---|
| Formula | C9H18N6O13P3+ |
| IUPAC Name | [[(2r,3s,4r,5r)-5-(4-amino-2-oxo-1h-pyrimidin-1-ium-1-yl)-3-hydroxy-4-[(imino-λ5-azanylidene)amino]tetrahydrofuran-2-yl]methoxy-hydroxy-phosphoryl] phosphono hydrogen phosphate |
| Molecular Mass | 511.193 g·mol−1 |
| Heat of Formation | -2874.4 ± 16.7 kJ·mol−1 |
| Dipole Moment | 6.08 ± 1.08 D |
| Volume | 472.41 Å 3 |
| Surface Area | 370.68 Å 2 |
| HOMO Energy | -9.58 ± 0.55 eV |
| LUMO Energy | -1.65 ± eV |
| Point Group Symmetry | C1 |
| InChIKey | AUZPRYHFWHKGKL-XVFCMESISA-O |
| QR Code | Generate QR Code |
| Links | |
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| Downloads | Get JSON data Get MOL2 data Get SVG Image |
| Elements | P C H O N |