[(2R,3R,4S,5R)-5-[[[[(2R,3S,4R,5R)-5-(6-Amino-8H-Purin-9-Ium-8-Ylium-9-Yl)-3,4-Dihydroxy-Tetrahydrofuran-2-Yl]Methoxy-Hydroxy-Phosphoryl]Oxy-Hydroxy-Phosphoryl]Oxymethyl]-3,4-Dihydroxy-Tetrahydrofuran-2-Yl] Acetate
Properties
| Property | Value |
|---|---|
| Formula | C17H25N5O15P2 |
| IUPAC Name | [(2r,3r,4s,5r)-5-[[[[(2r,3s,4r,5r)-5-(6-aminopurin-9-yl)-3,4-dihydroxy-tetrahydrofuran-2-yl]methoxy-hydroxy-phosphoryl]oxy-hydroxy-phosphoryl]oxymethyl]-3,4-dihydroxy-tetrahydrofuran-2-yl] acetate |
| Molecular Mass | 601.352 g·mol−1 |
| Heat of Formation | -3159.3 ± 16.7 kJ·mol−1 |
| Dipole Moment | 1.89 ± 1.08 D |
| Volume | 592.01 Å 3 |
| Surface Area | 417.39 Å 2 |
| HOMO Energy | -9.23 ± 0.55 eV |
| LUMO Energy | -1.75 ± eV |
| Point Group Symmetry | C1 |
| InChIKey | IJOUKWCBVUMMCR-DLFWLGJNSA-N |
| QR Code | Generate QR Code |
| Links | PubChem |
| DOI | |
| Downloads | Get JSON data Get MOL2 data Get SVG Image |
| Elements | P C H O N |