[(2R,3S,5R)-5-(4-Amino-2-Oxo-Pyrimidin-3-Ium-1-Yl)-2-(Phosphonooxymethyl)Tetrahydrofuran-3-Yl] [(2R,3S,4R,5R)-5-(6-Aminopurine-1,3,7-Triium-9-Yl)-3,4-Dihydroxy-Tetrahydrofuran-2-Yl]Methyl Hydrogen Phosphate
Properties
| Property | Value |
|---|---|
| Formula | C19H26N8O13P2+ |
| IUPAC Name | [(2r,3s,5r)-5-(4-amino-2-oxo-pyrimidin-3-ium-1-yl)-2-(phosphonooxymethyl)tetrahydrofuran-3-yl] [(2r,3s,4r,5r)-5-(6-aminopurine-1,3,7-triium-9-yl)-3,4-dihydroxy-tetrahydrofuran-2-yl]methyl hydrogen phosphate |
| Molecular Mass | 636.403 g·mol−1 |
| Heat of Formation | -2597.6 ± 16.7 kJ·mol−1 |
| Dipole Moment | 5.51 ± 1.08 D |
| Volume | 642.63 Å 3 |
| Surface Area | 460.5 Å 2 |
| HOMO Energy | -9.14 ± 0.55 eV |
| LUMO Energy | -0.57 ± eV |
| Point Group Symmetry | C1 |
| InChIKey | YHAMHLXNUTUFCW-LNAOLWRRSA-P |
| QR Code | Generate QR Code |
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| Downloads | Get JSON data Get MOL2 data Get SVG Image |
| Elements | P C H O N |