[(2R,3S,5R)-5-(2-Amino-6-Oxo-1H-Purine-3,7-Diium-9-Yl)-3-Hydroxy-Tetrahydrofuran-2-Yl]Methyl [(2S,3R,5R)-5-(4-Amino-2-Oxo-Pyrimidin-3-Ium-1-Yl)-2-(Hydroxymethyl)Tetrahydrofuran-3-Yl] Hydrogen Phosphate
Properties
| Property | Value |
|---|---|
| Formula | C19H27N8O10P++ |
| IUPAC Name | [(2r,3s,5r)-5-(2-amino-6-oxo-1h-purine-3,7-diium-9-yl)-3-hydroxy-tetrahydrofuran-2-yl]methyl [(2s,3r,5r)-5-(4-amino-2-oxo-pyrimidin-3-ium-1-yl)-2-(hydroxymethyl)tetrahydrofuran-3-yl] hydrogen phosphate |
| Molecular Mass | 558.439 g·mol−1 |
| Heat of Formation | -1819.4 ± 16.7 kJ·mol−1 |
| Dipole Moment | 3.78 ± 1.08 D |
| Volume | 574.4 Å 3 |
| Surface Area | 402.8 Å 2 |
| HOMO Energy | -8.83 ± 0.55 eV |
| LUMO Energy | -0.37 ± eV |
| Point Group Symmetry | C1 |
| InChIKey | WPJOTLYWBLWWQI-SCYBVZLVSA-Q |
| 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 |