(6Z)-4-Methyl-6-(5-Phenyl-1,2-Dihydro-3H-Pyrazol-3-Ylidene)-2,4-Cyclohexadien-1-One
Properties
| Property | Value |
|---|---|
| Formula | C16H14N2O |
| IUPAC Name | (6e)-4-methyl-6-(5-phenylpyrazole-1,2-diium-3-ylidene)cyclohexa-2,4-dien-1-one |
| Molecular Mass | 250.295 g·mol−1 |
| Heat of Formation | 255.3 ± 16.7 kJ·mol−1 |
| Dipole Moment | 5.19 ± 1.08 D |
| Volume | 301.58 Å 3 |
| Surface Area | 283.35 Å 2 |
| HOMO Energy | -8.04 ± 0.55 eV |
| LUMO Energy | -1.28 ± eV |
| Point Group Symmetry | C1 |
| InChIKey | RFDOKDAIYRJYJJ-FYWRMAATSA-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 |