2-Anilino-4-[2-(1H-Imidazol-5-Yl)Ethylamino]-6H-Pyrazolo[1,5-A][1,3,5]Triazin-5-Ium-8-Carbonitrile
Properties
| Property | Value |
|---|---|
| Formula | C17H16N9+ |
| IUPAC Name | 2-anilino-4-[2-(1h-imidazol-5-yl)ethylamino]-6h-pyrazolo[1,5-a][1,3,5]triazin-5-ium-8-carbonitrile |
| Molecular Mass | 346.369 g·mol−1 |
| Heat of Formation | 739.1 ± 16.7 kJ·mol−1 |
| Dipole Moment | 7.27 ± 1.08 D |
| Volume | 398.71 Å 3 |
| Surface Area | 372.66 Å 2 |
| HOMO Energy | -8.86 ± 0.55 eV |
| LUMO Energy | -0.96 ± eV |
| Point Group Symmetry | C1 |
| InChIKey | LLCCOKFREUFZIU-UHFFFAOYSA-O |
| QR Code | Generate QR Code |
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| Elements | H C N |