N-{2-[(4-Azido-3,5,6-Trifluoro-2-Pyridinyl)Amino]Ethyl}Adenosine 5'-(Dihydrogen Phosphate)
Properties
| Property | Value |
|---|---|
| Formula | C17H18F3N10O7P |
| IUPAC Name | [(2r,3s,4r,5r)-5-[6-[2-[(4-azido-3,5,6-trifluoro-pyridin-1-ium-3-id-2-yl)amino]ethylamino]purine-1,3,7-triium-9-yl]-3,4-dihydroxy-tetrahydrofuran-2-yl]methyl dihydrogen phosphate |
| Molecular Mass | 562.357 g·mol−1 |
| Heat of Formation | 405.2 ± 16.7 kJ·mol−1 |
| Dipole Moment | 7.41 ± 1.08 D |
| Volume | 518.96 Å 3 |
| Surface Area | 477.14 Å 2 |
| HOMO Energy | -9.61 ± 0.55 eV |
| LUMO Energy | -3.16 ± eV |
| Point Group Symmetry | C1 |
| InChIKey | SVKFLRCQHUOPDJ-XFDMUNLNSA-N |
| QR Code | Generate QR Code |
| Links | PubChem ChemSpider |
| DOI | |
| Downloads | Get JSON data Get MOL2 data Get SVG Image |
| Elements | P C N O F |