N-[9-Chloro-2-(2-Furyl)-[1,2,4]Triazolo[1,5-C]Quinazolin-4-Ium-6A-Id-5-Yl]-2-Phenyl-Acetamide
Properties
| Property | Value |
|---|---|
| Formula | C21H17ClN5O2 |
| IUPAC Name | n-[9-chloro-2-(2-furyl)-[1,2,4]triazolo[1,5-c]quinazolin-4-ium-6a-id-5-yl]-2-phenyl-acetamide |
| Molecular Mass | 406.845 g·mol−1 |
| Heat of Formation | 322.3 ± 16.7 kJ·mol−1 |
| Dipole Moment | 4.68 ± 1.08 D |
| Volume | 441.75 Å 3 |
| Surface Area | 401.7 Å 2 |
| HOMO Energy | -9.16 ± 0.55 eV |
| LUMO Energy | -1.27 ± eV |
| Point Group Symmetry | C1 |
| InChIKey | KYAXGKMXJPOION-UHFFFAOYSA-O |
| QR Code | Generate QR Code |
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| Elements | H C N O Cl |