[(2R,3R,4R,5R)-2-(6-Aminopurine-1,3,7-Triium-9-Yl)-4-Hydroxy-5-[[Hydroxy(Phosphonooxy)Phosphoryl]Oxymethyl]Tetrahydrofuran-3-Yl] 4-(4-Azido-2-Nitro-Anilino)Butanoate
Properties
| Property | Value |
|---|---|
| Formula | C20H25N10O13P2 |
| IUPAC Name | [(2r,3r,4r,5r)-2-(6-aminopurine-1,3,7-triium-9-yl)-4-hydroxy-5-[[hydroxy(phosphonooxy)phosphoryl]oxymethyl]tetrahydrofuran-3-yl] 4-(4-azido-2-nitro-anilino)butanoate |
| Molecular Mass | 675.419 g·mol−1 |
| Heat of Formation | -1990.2 ± 16.7 kJ·mol−1 |
| Dipole Moment | 7.57 ± 1.08 D |
| Volume | 695.24 Å 3 |
| Surface Area | 493.35 Å 2 |
| HOMO Energy | -8.77 ± 0.55 eV |
| LUMO Energy | -1.26 ± eV |
| Point Group Symmetry | C1 |
| InChIKey | OBNFMECKQZMPLX-AEVYOOLXSA-O |
| QR Code | Generate QR Code |
| Links | |
| DOI | |
| Downloads | Get JSON data Get MOL2 data Get SVG Image |
| Elements | P C H O N |