2-[[(2R,3R,5S)-2-(2-Amino-6-Oxo-3H-Purine-1,7-Diium-4-Id-9-Yl)-5-(Hydroxymethyl)Tetrahydrofuran-3-Yl]Oxy-Hydroxy-Phosphoryl]Oxyacetic Acid
Properties
| Property | Value |
|---|---|
| Formula | C12H18N5O9P+ |
| IUPAC Name | 2-[[(2r,3r,5s)-2-(2-amino-6-oxo-3h-purine-1,7-diium-4-id-9-yl)-5-(hydroxymethyl)tetrahydrofuran-3-yl]oxy-hydroxy-phosphoryl]oxyacetic acid |
| Molecular Mass | 407.273 g·mol−1 |
| Heat of Formation | -1659.7 ± 16.7 kJ·mol−1 |
| Dipole Moment | 12.29 ± 1.08 D |
| Volume | 406.34 Å 3 |
| Surface Area | 322.69 Å 2 |
| HOMO Energy | -9.12 ± 0.55 eV |
| LUMO Energy | -1.60 ± eV |
| Point Group Symmetry | C1 |
| InChIKey | ZQDDSKRPDXJFDI-WGDKSQQYSA-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 |