5'-Deoxy-5'-(4-{[(2,3-Dihydroxy-5-Nitrobenzoyl)Amino]Methyl}-1H-1,2,3-Triazol-1-Yl)Adenosine
Properties
| Property | Value |
|---|---|
| Formula | C20H20N10O8 |
| IUPAC Name | n-[[1-[[(2r,3s,4r,5r)-5-(6-aminopurin-9-yl)-3,4-dihydroxy-tetrahydrofuran-2-yl]methyl]triazol-4-yl]methyl]-2,3-dihydroxy-5-nitro-benzamide |
| Molecular Mass | 528.435 g·mol−1 |
| Heat of Formation | -420.4 ± 16.7 kJ·mol−1 |
| Dipole Moment | 5.34 ± 1.08 D |
| Volume | 567.31 Å 3 |
| Surface Area | 460.63 Å 2 |
| HOMO Energy | -8.93 ± 0.55 eV |
| LUMO Energy | -1.47 ± eV |
| Point Group Symmetry | C1 |
| InChIKey | KWTYQIOJSHGBKG-VXHCAWKWSA-N |
| QR Code | Generate QR Code |
| Links | PubChem ChemSpider |
| DOI | |
| Downloads | Get JSON data Get MOL2 data Get SVG Image |
| Elements | H C O N |