(2S,4Ar,6R,7R,7As)-6-(6-Amino-8-Bromo-Purine-1,3,7-Triium-9-Yl)-2-Hydroxy-2-Oxo-4A,6,7,7A-Tetrahydro-4H-Furo[3,2-D][1,3,2]Dioxaphosphinin-7-Ol
Properties
| Property | Value |
|---|---|
| Formula | C10H11BrN5O6P |
| IUPAC Name | (2s,4ar,6r,7r,7as)-6-(6-amino-8-bromo-purine-1,3,7-triium-9-yl)-2-hydroxy-2-oxo-4a,6,7,7a-tetrahydro-4h-furo[3,2-d][1,3,2]dioxaphosphinin-7-ol |
| Molecular Mass | 408.102 g·mol−1 |
| Heat of Formation | -988.3 ± 16.7 kJ·mol−1 |
| Dipole Moment | 3.82 ± 1.08 D |
| Volume | 353.26 Å 3 |
| Surface Area | 303.9 Å 2 |
| HOMO Energy | -9.24 ± 0.55 eV |
| LUMO Energy | -1.22 ± eV |
| Point Group Symmetry | C1 |
| InChIKey | KKNLSLVTTGBEBA-UUOKFMHZSA-O |
| QR Code | Generate QR Code |
| Links | |
| DOI | |
| Downloads | Get JSON data Get MOL2 data Get SVG Image |
| Elements | C H O N P Br |