2-Amino-9-{5-O-[{[Hydroxy(Phosphonooxy)Phosphoryl]Oxy}(Sulfanyl)Phosphoryl]Pentofuranosyl}-1,9-Dihydro-6H-Purin-6-One
Properties
| Property | Value |
|---|---|
| Formula | C10H16N5O13P3S |
| IUPAC Name | (r)-[(2r,3s,4s,5r)-5-(2-amino-6-oxo-1h-purine-3,7-diium-9-yl)-3,4-dihydroxy-tetrahydrofuran-2-yl]methoxy-hydroxy-[hydroxy(phosphonooxy)phosphoryl]oxy-sulfido-phosphonium |
| Molecular Mass | 539.246 g·mol−1 |
| Heat of Formation | -801.5 ± 16.7 kJ·mol−1 |
| Dipole Moment | 8.37 ± 1.08 D |
| Volume | 465.63 Å 3 |
| Surface Area | 399.99 Å 2 |
| HOMO Energy | -9.11 ± 0.55 eV |
| LUMO Energy | -4.61 ± eV |
| Point Group Symmetry | C1 |
| InChIKey | YRUWXBKVSXSSGS-KIOICMOXSA-N |
| QR Code | Generate QR Code |
| Links | ChemSpider |
| DOI | |
| Downloads | Get JSON data Get MOL2 data Get SVG Image |
| Elements | P C S O N |