Pyrazolo[3,4-D]Pyrimidine-1,2,7-Triium-4,6-Dione
Properties
| Property | Value |
|---|---|
| Formula | C5H9N4O2+ |
| IUPAC Name | (3as,7as)-1,2,3,3a,7,7a-hexahydropyrazolo[3,4-d]pyrimidin-5-ium-4,6-dione |
| Molecular Mass | 157.151 g·mol−1 |
| Heat of Formation | -46.2 ± 16.7 kJ·mol−1 |
| Dipole Moment | 7.74 ± 1.08 D |
| Volume | 154.93 Å 3 |
| Surface Area | 160.14 Å 2 |
| HOMO Energy | -10.01 ± 0.55 eV |
| LUMO Energy | 1.34 ± eV |
| Point Group Symmetry | C1 |
| InChIKey | IKIQXZAVRRDTPI-UHFFFAOYSA-P |
| QR Code | Generate QR Code |
| Links | |
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| Downloads | Get JSON data Get MOL2 data Get SVG Image |
| Elements | H C O N |