[(2S,3R,5R)-5-(6-Benzamidopurine-1,3,7-Triium-9-Yl)-3-Hydroxy-Tetrahydrofuran-2-Yl]Methyl Dihydrogen Phosphate
Properties
| Property | Value |
|---|---|
| Formula | C17H18N5O7P |
| IUPAC Name | [(2s,3r,5r)-5-(6-benzamidopurine-1,3,7-triium-9-yl)-3-hydroxy-tetrahydrofuran-2-yl]methyl dihydrogen phosphate |
| Molecular Mass | 435.328 g·mol−1 |
| Heat of Formation | -1167.6 ± 16.7 kJ·mol−1 |
| Dipole Moment | 7.03 ± 1.08 D |
| Volume | 457.27 Å 3 |
| Surface Area | 408.0 Å 2 |
| HOMO Energy | -9.07 ± 0.55 eV |
| LUMO Energy | -0.64 ± eV |
| Point Group Symmetry | C1 |
| InChIKey | OVYARZLMARYZEA-FRRDWIJNSA-O |
| QR Code | Generate QR Code |
| Links | |
| DOI | |
| Downloads | Get JSON data Get MOL2 data Get SVG Image |
| Elements | P C H O N |