4-Methyl-5-Oxo-3-(2-Phenylethyl)-5H-1,2,3-Oxadiazol-3-Ium-2-Ide
Properties
| Property | Value |
|---|---|
| Formula | C11H12N2O2 |
| IUPAC Name | 4-methyl-3-(2-phenylethyl)oxadiazol-3-ium-5-olate |
| Molecular Mass | 204.225 g·mol−1 |
| Heat of Formation | 33.0 ± 16.7 kJ·mol−1 |
| Dipole Moment | 6.68 ± 1.08 D |
| Volume | 249.86 Å 3 |
| Surface Area | 224.78 Å 2 |
| HOMO Energy | -8.82 ± 0.55 eV |
| LUMO Energy | 2.44 ± eV |
| Point Group Symmetry | C1 |
| InChIKey | BNJCAPQZAQOQRK-UHFFFAOYSA-N |
| QR Code | Generate QR Code |
| Links | PubChem ChemSpider |
| DOI | |
| Downloads | Get JSON data Get MOL2 data Get SVG Image |
| Elements | H C O N |