[(2R,3S,4R,5R)-5-(6-Amino-8-Bromo-Purine-1,3,7-Triium-9-Yl)-3,4-Dihydroxy-Tetrahydrofuran-2-Yl]Methyl Dihydrogen Phosphate
Properties
| Property | Value |
|---|---|
| Formula | C10H15BrN5O7P |
| IUPAC Name | [(2r,3s,4r,5r)-5-(6-amino-8-bromo-purine-1,3,7-triium-9-yl)-3,4-dihydroxy-tetrahydrofuran-2-yl]methyl dihydrogen phosphate |
| Molecular Mass | 428.133 g·mol−1 |
| Heat of Formation | -1291.5 ± 16.7 kJ·mol−1 |
| Dipole Moment | 2.38 ± 1.08 D |
| Volume | 382.32 Å 3 |
| Surface Area | 322.96 Å 2 |
| HOMO Energy | -9.15 ± 0.55 eV |
| LUMO Energy | -0.79 ± eV |
| Point Group Symmetry | C1 |
| InChIKey | UZENOOOPVPDBCC-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 |