[(2R,3S,5R)-5-[6-Amino-8-[(E)-Benzylideneamino]Purine-1,3,7-Triium-9-Yl]-2-(Hydroxymethyl)Tetrahydrofuran-3-Yl] Dihydrogen Phosphate
Properties
| Property | Value |
|---|---|
| Formula | C17H19N6O6P |
| IUPAC Name | [(2r,3s,5r)-5-[6-amino-8-[(e)-benzylideneamino]purine-1,3,7-triium-9-yl]-2-(hydroxymethyl)tetrahydrofuran-3-yl] dihydrogen phosphate |
| Molecular Mass | 434.343 g·mol−1 |
| Heat of Formation | -968.3 ± 16.7 kJ·mol−1 |
| Dipole Moment | 6.26 ± 1.08 D |
| Volume | 455.35 Å 3 |
| Surface Area | 396.25 Å 2 |
| HOMO Energy | -8.85 ± 0.55 eV |
| LUMO Energy | -1.60 ± eV |
| Point Group Symmetry | C1 |
| InChIKey | GTUVWRINQKCZMH-HPNSUZEISA-O |
| QR Code | Generate QR Code |
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| Downloads | Get JSON data Get MOL2 data Get SVG Image |
| Elements | P C H O N |