[[(2R,3S,4R,5R)-5-(6-Amino-2-Azido-Purine-1,3,7-Triium-9-Yl)-3,4-Dihydroxy-Tetrahydrofuran-2-Yl]Methoxy-Hydroxy-Phosphoryl] [(2R,3S,4R,5R)-5-(3-Carbamoyl-4H-Pyridin-4-Id-1-Yl)-3,4-Dihydroxy-Tetrahydrofuran-2-Yl]Methyl Phosphate
Properties
| Property | Value |
|---|---|
| Formula | C21H30N10O14P2 |
| IUPAC Name | [[(2r,3s,4r,5r)-5-(6-amino-2-azido-purine-1,3,7-triium-9-yl)-3,4-dihydroxy-tetrahydrofuran-2-yl]methoxy-hydroxy-phosphoryl] [(2r,3s,4r,5r)-5-(3-carbamoyl-4h-pyridin-4-id-1-yl)-3,4-dihydroxy-tetrahydrofuran-2-yl]methyl phosphate |
| Molecular Mass | 708.469 g·mol−1 |
| Heat of Formation | -2366.7 ± 16.7 kJ·mol−1 |
| Dipole Moment | 9.67 ± 1.08 D |
| Volume | 682.81 Å 3 |
| Surface Area | 438.44 Å 2 |
| HOMO Energy | -8.93 ± 0.55 eV |
| LUMO Energy | -1.49 ± eV |
| Point Group Symmetry | C1 |
| InChIKey | FDBPWRIVPZROOX-NAJQWHGHSA-P |
| QR Code | Generate QR Code |
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| Elements | P C H O N |