4-{[(4Ar,6R,7R,7Ar)-6-(6-Amino-9H-Purin-9-Yl)-2-Hydroxy-2-Oxidotetrahydro-4H-Furo[3,2-D][1,3,2]Dioxaphosphinin-7-Yl]Oxy}-4-Oxobutanoic Acid
Properties
| Property | Value |
|---|---|
| Formula | C14H16N5O9P |
| IUPAC Name | 4-[[(2s,4as,6r,7r,7as)-6-(6-aminopurine-1,3,7-triium-9-yl)-2-hydroxy-2-oxo-4a,6,7,7a-tetrahydro-4h-furo[3,2-d][1,3,2]dioxaphosphinin-7-yl]oxy]-4-oxo-butanoic acid |
| Molecular Mass | 429.279 g·mol−1 |
| Heat of Formation | -1571.2 ± 16.7 kJ·mol−1 |
| Dipole Moment | 7.77 ± 1.08 D |
| Volume | 429.0 Å 3 |
| Surface Area | 346.59 Å 2 |
| HOMO Energy | -9.68 ± 0.55 eV |
| LUMO Energy | -1.49 ± eV |
| Point Group Symmetry | C1 |
| InChIKey | QNPSLGPIZRJDAN-MLYBJDBDSA-N |
| QR Code | Generate QR Code |
| Links | PubChem ChemSpider |
| DOI | |
| Downloads | Get JSON data Get MOL2 data Get SVG Image |
| Elements | P C H O N |