[(2R,3S,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 | [(2r,3s,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 | -1168.0 ± 16.7 kJ·mol−1 |
| Dipole Moment | 4.67 ± 1.08 D |
| Volume | 456.59 Å 3 |
| Surface Area | 404.42 Å 2 |
| HOMO Energy | -9.16 ± 0.55 eV |
| LUMO Energy | -1.01 ± eV |
| Point Group Symmetry | C1 |
| InChIKey | OVYARZLMARYZEA-YNEHKIRRSA-O |
| QR Code | Generate QR Code |
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| Elements | P C H O N |