1-[1-(4-Methylphenyl)-3-(2-Methyl-2-Propanyl)-1H-Pyrazol-5-Yl]-3-{3-[(5-Oxo-6,7,8,9-Tetrahydro-5H-Benzo[7]Annulen-2-Yl)Amino]Phenyl}Urea
Properties
| Property | Value |
|---|---|
| Formula | C32H35N5O2 |
| IUPAC Name | 1-[5-tert-butyl-2-(p-tolyl)pyrazol-2-ium-3-ylium-3-yl]-3-[3-[(5-oxo-6,7,8,9-tetrahydrobenzo[7]annulen-2-yl)amino]phenyl]urea |
| Molecular Mass | 521.653 g·mol−1 |
| Heat of Formation | 20.8 ± 16.7 kJ·mol−1 |
| Dipole Moment | 5.58 ± 1.08 D |
| Volume | 639.46 Å 3 |
| Surface Area | 557.62 Å 2 |
| HOMO Energy | -8.32 ± 0.55 eV |
| LUMO Energy | 2.56 ± eV |
| Point Group Symmetry | C1 |
| InChIKey | ZPGBLWCHXWTWDI-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 |