[(2R,3S,4R,5R)-5-(6-Aminopurine-1,3,7-Triium-9-Yl)-4-Hydroxy-2-[[Hydroxy(Phosphonooxy)Phosphoryl]Oxymethyl]Tetrahydrofuran-3-Yl] 5-Azidonaphthalene-1-Carboxylate
Properties
| Property | Value |
|---|---|
| Formula | C21H21N8O11P2 |
| IUPAC Name | [(2r,3s,4r,5r)-5-(6-aminopurine-1,3,7-triium-9-yl)-4-hydroxy-2-[[hydroxy(phosphonooxy)phosphoryl]oxymethyl]tetrahydrofuran-3-yl] 5-azidonaphthalene-1-carboxylate |
| Molecular Mass | 623.386 g·mol−1 |
| Heat of Formation | -1788.9 ± 16.7 kJ·mol−1 |
| Dipole Moment | 1.55 ± 1.08 D |
| Volume | 633.05 Å 3 |
| Surface Area | 529.37 Å 2 |
| HOMO Energy | -8.99 ± 0.55 eV |
| LUMO Energy | -1.62 ± eV |
| Point Group Symmetry | C1 |
| InChIKey | CBYFOXLTFKXGSM-WVSUBDOOSA-O |
| QR Code | Generate QR Code |
| Links | |
| DOI | |
| Downloads | Get JSON data Get MOL2 data Get SVG Image |
| Elements | P C H O N |