[[[(2R,3S,4R,5R)-5-(6-Aminopurine-1,3,7-Triium-9-Yl)-3,4-Dihydroxy-Tetrahydrofuran-2-Yl]Methoxy-Hydroxy-Phosphoryl]Oxy-Hydroxy-Phosphoryl]Oxy-N-(5-Sulfo-1-Naphthyl)Phosphonamidic Acid
Properties
| Property | Value |
|---|---|
| Formula | C20H25N6O15P3S |
| IUPAC Name | [[[(2r,3s,4r,5r)-5-(6-aminopurine-1,3,7-triium-9-yl)-3,4-dihydroxy-tetrahydrofuran-2-yl]methoxy-hydroxy-phosphoryl]oxy-hydroxy-phosphoryl]oxy-n-(5-sulfo-1-naphthyl)phosphonamidic acid |
| Molecular Mass | 714.430 g·mol−1 |
| Heat of Formation | -3218.5 ± 16.7 kJ·mol−1 |
| Dipole Moment | 10.75 ± 1.08 D |
| Volume | 678.91 Å 3 |
| Surface Area | 468.29 Å 2 |
| HOMO Energy | -8.16 ± 0.55 eV |
| LUMO Energy | -1.71 ± eV |
| Point Group Symmetry | C1 |
| InChIKey | VANDRPJMUXATER-AEVYOOLXSA-O |
| QR Code | Generate QR Code |
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| Downloads | Get JSON data Get MOL2 data Get SVG Image |
| Elements | C H O N P S |