9-(5-O-{[(2E)-2-Buten-1-Yloxy](Hydroxy)Phosphoryl}-2-O-[Dimethyl(2-Methyl-2-Propanyl)Silyl]-β-D-Ribofuranosyl)-2-{(E)-[(Dimethylamino)Methylene]Amino}-9H-Purine
Properties
| Property | Value |
|---|---|
| Formula | C23H39N6O7PSi |
| IUPAC Name | [(e)-but-2-enyl] [(2r,3r,4r,5r)-4-[tert-butyl(dimethyl)silyl]oxy-5-[2-[(e)-dimethylaminomethyleneamino]purine-1,3,7-triium-9-yl]-3-hydroxy-tetrahydrofuran-2-yl]methyl hydrogen phosphate |
| Molecular Mass | 570.651 g·mol−1 |
| Heat of Formation | -1447.7 ± 16.7 kJ·mol−1 |
| Dipole Moment | 7.83 ± 1.08 D |
| Volume | 680.45 Å 3 |
| Surface Area | 479.9 Å 2 |
| HOMO Energy | -8.73 ± 0.55 eV |
| LUMO Energy | -0.85 ± eV |
| Point Group Symmetry | C1 |
| InChIKey | XPWZMBJMSZSSNC-SQTPBEOXSA-N |
| QR Code | Generate QR Code |
| Links | PubChem ChemSpider |
| DOI | |
| Downloads | Get JSON data Get MOL2 data Get SVG Image |
| Elements | C H O N P Si |