9-(2-Deoxy-5-O-Phosphonopentofuranosyl)-N-(2-Hydroxy-2-Phenylethyl)-9H-Purin-6-Amine
Properties
| Property | Value |
|---|---|
| Formula | C18H22N5O7P |
| IUPAC Name | [(2r,3s,5r)-3-hydroxy-5-[6-[[(2r)-2-hydroxy-2-phenyl-ethyl]amino]purine-1,3,7-triium-9-yl]tetrahydrofuran-2-yl]methyl dihydrogen phosphate |
| Molecular Mass | 451.370 g·mol−1 |
| Heat of Formation | -1240.0 ± 16.7 kJ·mol−1 |
| Dipole Moment | 4.46 ± 1.08 D |
| Volume | 495.83 Å 3 |
| Surface Area | 413.91 Å 2 |
| HOMO Energy | -8.89 ± 0.55 eV |
| LUMO Energy | -0.59 ± eV |
| Point Group Symmetry | C1 |
| InChIKey | XQQQZMWASYSYAT-BYNSBNAKSA-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 |