[(2S,3S,4R,5R)-5-(6-Aminopurine-1,3,7-Triium-9-Yl)-2-[[[(2R,3S,4R,5R)-5-(6-Aminopurine-1,3,7-Triium-9-Yl)-3,4-Dihydroxy-Tetrahydrofuran-2-Yl]Oxy-Hydroxy-Phosphoryl]Oxymethyl]-4-Hydroxy-Tetrahydrofuran-3-Yl]Methoxy-Dihydroxy-Sulfido-Phosphonium
Properties
| Property | Value |
|---|---|
| Formula | C20H27N10O12P2S |
| IUPAC Name | [(2s,3s,4r,5r)-5-(6-aminopurine-1,3,7-triium-9-yl)-2-[[[(2r,3s,4r,5r)-5-(6-aminopurine-1,3,7-triium-9-yl)-3,4-dihydroxy-tetrahydrofuran-2-yl]oxy-hydroxy-phosphoryl]oxymethyl]-4-hydroxy-tetrahydrofuran-3-yl]methoxy-dihydroxy-sulfido-phosphonium |
| Molecular Mass | 693.501 g·mol−1 |
| Heat of Formation | -2226.1 ± 16.7 kJ·mol−1 |
| Dipole Moment | 2.54 ± 1.08 D |
| Volume | 685.2 Å 3 |
| Surface Area | 507.98 Å 2 |
| HOMO Energy | -9.01 ± 0.55 eV |
| LUMO Energy | -0.60 ± eV |
| Point Group Symmetry | C1 |
| InChIKey | WMVJURFCLFWPTN-XQLJQEBPSA-P |
| QR Code | Generate QR Code |
| Links | |
| DOI | |
| Downloads | Get JSON data Get MOL2 data Get SVG Image |
| Elements | C H O N P S |