[(2R,3S,4R,5R)-5-(6-Aminopurine-1,3,7-Triium-9-Yl)-3,4-Dihydroxy-Tetrahydrofuran-2-Yl]Methyl [(2S,3S,4R,5R)-5-(2,4-Dioxopyrimidin-1-Yl)-3,4-Dihydroxy-Tetrahydrofuran-2-Yl]Methyl Phosphono Phosphate
Properties
| Property | Value |
|---|---|
| Formula | C19H25N7O15P2++ |
| IUPAC Name | [(2r,3s,4r,5r)-5-(6-aminopurine-1,3,7-triium-9-yl)-3,4-dihydroxy-tetrahydrofuran-2-yl]methyl [(2s,3s,4r,5r)-5-(2,4-dioxopyrimidin-1-yl)-3,4-dihydroxy-tetrahydrofuran-2-yl]methyl phosphono phosphate |
| Molecular Mass | 653.387 g·mol−1 |
| Heat of Formation | -3007.9 ± 16.7 kJ·mol−1 |
| Dipole Moment | 1.92 ± 1.08 D |
| Volume | 647.17 Å 3 |
| Surface Area | 460.76 Å 2 |
| HOMO Energy | -9.30 ± 0.55 eV |
| LUMO Energy | -1.24 ± eV |
| Point Group Symmetry | C1 |
| InChIKey | WWHHXUKFMNEJRH-YNKFEZEBSA-Q |
| QR Code | Generate QR Code |
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| Downloads | Get JSON data Get MOL2 data Get SVG Image |
| Elements | P C H O N |