(S)-[(2R,3S,5R)-5-(6-Aminopurine-1,3,7-Triium-9-Yl)-2-(Hydroxymethyl)Tetrahydrofuran-3-Yl]Oxy-Hydroxy-[[(2R,3S,5R)-3-Hydroxy-5-(5-Methyl-2,4-Dioxo-Pyrimidin-1-Yl)Tetrahydrofuran-2-Yl]Methoxy]-Sulfido-Phosphonium
Properties
| Property | Value |
|---|---|
| Formula | C20H27N7O9PS++ |
| IUPAC Name | (s)-[(2r,3s,5r)-5-(6-aminopurine-1,3,7-triium-9-yl)-2-(hydroxymethyl)tetrahydrofuran-3-yl]oxy-hydroxy-[[(2r,3s,5r)-3-hydroxy-5-(5-methyl-2,4-dioxo-pyrimidin-1-yl)tetrahydrofuran-2-yl]methoxy]-sulfido-phosphonium |
| Molecular Mass | 572.509 g·mol−1 |
| Heat of Formation | -1670.3 ± 16.7 kJ·mol−1 |
| Dipole Moment | 4.66 ± 1.08 D |
| Volume | 598.9 Å 3 |
| Surface Area | 416.78 Å 2 |
| HOMO Energy | -8.88 ± 0.55 eV |
| LUMO Energy | -0.65 ± eV |
| Point Group Symmetry | C1 |
| InChIKey | FKBZJSFHXXNJEK-HXXMQYRMSA-Q |
| QR Code | Generate QR Code |
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| Downloads | Get JSON data Get MOL2 data Get SVG Image |
| Elements | C H O N P S |