9-(6-Deoxy-6,6-Difluoro-2-Thiohexofuranosyl)-9H-Purin-6-Amine
Properties
| Property | Value |
|---|---|
| Formula | C11H13F2N5O3S |
| IUPAC Name | (2r,3r,4s,5s)-5-(6-aminopurine-1,3,7-triium-9-yl)-2-[(1s)-2,2-difluoro-1-hydroxy-ethyl]-4-sulfanyl-tetrahydrofuran-3-ol |
| Molecular Mass | 333.314 g·mol−1 |
| Heat of Formation | -714.8 ± 16.7 kJ·mol−1 |
| Dipole Moment | 4.58 ± 1.08 D |
| Volume | 344.38 Å 3 |
| Surface Area | 300.38 Å 2 |
| HOMO Energy | -9.38 ± 0.55 eV |
| LUMO Energy | 2.11 ± eV |
| Point Group Symmetry | C1 |
| InChIKey | PDQSVYDBRJLXCV-PNCMYUHXSA-N |
| QR Code | Generate QR Code |
| Links | ChemSpider |
| DOI | |
| Downloads | Get JSON data Get MOL2 data Get SVG Image |
| Elements | C F H O N S |