[(2R,3S,5R)-5-(2-Amino-6-Oxo-3H-Purine-1,7-Diium-4-Id-9-Yl)-2-(Phosphonooxymethyl)Tetrahydrofuran-3-Yl] [(2R,3S,5R)-3-Hydroxy-5-(5-Methyl-2,4-Dioxo-Pyrimidin-1-Yl)Tetrahydrofuran-2-Yl]Methyl Hydrogen Phosphate
Properties
| Property | Value |
|---|---|
| Formula | C20H29N7O14P2+++ |
| IUPAC Name | [(2r,3s,5r)-5-(2-amino-6-oxo-3h-purine-1,7-diium-4-id-9-yl)-2-(phosphonooxymethyl)tetrahydrofuran-3-yl] [(2r,3s,5r)-3-hydroxy-5-(5-methyl-2,4-dioxo-pyrimidin-1-ium-5-id-1-yl)tetrahydrofuran-2-yl]methyl hydrogen phosphate |
| Molecular Mass | 653.430 g·mol−1 |
| Heat of Formation | -2778.5 ± 16.7 kJ·mol−1 |
| Dipole Moment | 14.90 ± 1.08 D |
| Volume | 691.81 Å 3 |
| Surface Area | 504.77 Å 2 |
| HOMO Energy | -9.05 ± 0.55 eV |
| LUMO Energy | -1.05 ± eV |
| Point Group Symmetry | C1 |
| InChIKey | WTQBUPKSDCSNJT-PRSXHHODSA-R |
| QR Code | Generate QR Code |
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| Elements | P C H O N |