1,3-Dimethyl-7-[(1R)-3-Oxo-1H-Isobenzofuran-1-Yl]Purin-9-Ium-5-Ide-2,6-Dione
Properties
| Property | Value |
|---|---|
| Formula | C15H13N4O4 |
| IUPAC Name | 1,3-dimethyl-7-[(1r)-3-oxo-1h-isobenzofuran-1-yl]purin-9-ium-5-ide-2,6-dione |
| Molecular Mass | 313.288 g·mol−1 |
| Heat of Formation | -350.3 ± 16.7 kJ·mol−1 |
| Dipole Moment | 3.99 ± 1.08 D |
| Volume | 334.41 Å 3 |
| Surface Area | 296.5 Å 2 |
| HOMO Energy | -9.15 ± 0.55 eV |
| LUMO Energy | 1.70 ± eV |
| Point Group Symmetry | C1 |
| InChIKey | AXYVVUCRKCBYOH-GCZXYKMCSA-P |
| QR Code | Generate QR Code |
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| Elements | H C O N |