[(2R,3S,5R)-5-(2-Amino-6-Oxo-3H-Purine-1,7-Diium-4-Id-9-Yl)-2-[[Hydroxy-[Hydroxy(Phosphonooxy)Phosphoryl]Oxy-Phosphoryl]Oxymethyl]Tetrahydrofuran-3-Yl] Phosphono Hydrogen Phosphate
Properties
| Property | Value |
|---|---|
| Formula | C10H20N5O19P5+ |
| IUPAC Name | [(2r,3s,5r)-5-(2-amino-6-oxo-3h-purine-1,7-diium-4-id-9-yl)-2-[[hydroxy-[hydroxy(phosphonooxy)phosphoryl]oxy-phosphoryl]oxymethyl]tetrahydrofuran-3-yl] phosphono hydrogen phosphate |
| Molecular Mass | 669.157 g·mol−1 |
| Heat of Formation | -4744.6 ± 16.7 kJ·mol−1 |
| Dipole Moment | 7.29 ± 1.08 D |
| Volume | 604.86 Å 3 |
| Surface Area | 465.09 Å 2 |
| HOMO Energy | -9.29 ± 0.55 eV |
| LUMO Energy | -1.88 ± eV |
| Point Group Symmetry | C1 |
| InChIKey | PMTPWRWKXFAESP-KVQBGUIXSA-P |
| QR Code | Generate QR Code |
| Links | |
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| Downloads | Get JSON data Get MOL2 data Get SVG Image |
| Elements | P C H O N |