4-[(E)-{4-[(4,6-Dichloro-1,3,5-Triazin-2-Yl)Amino]-2-Sulfophenyl}Diazenyl]-5-Oxo-1-(4-Sulfophenyl)-4,5-Dihydro-1H-Pyrazole-3-Carboxylic Acid
Properties
| Property | Value |
|---|---|
| Formula | C19H12Cl2N8O9S2 |
| IUPAC Name | 4-[4-[(4,6-dichloro-1,3,5-triazin-2-yl)amino]-2-sulfo-phenyl]azo-5-oxo-1-(4-sulfophenyl)-4h-pyrazole-3-carboxylic acid |
| Molecular Mass | 631.383 g·mol−1 |
| Heat of Formation | 2309.9 ± 16.7 kJ·mol−1 |
| Dipole Moment | 14.57 ± 1.08 D |
| Volume | 577.82 Å 3 |
| Surface Area | 522.83 Å 2 |
| HOMO Energy | -9.43 ± 0.55 eV |
| LUMO Energy | -2.73 ± eV |
| Point Group Symmetry | C1 |
| InChIKey | IHRFTCGTRALYFG-IEUSNURDSA-N |
| QR Code | Generate QR Code |
| Links | PubChem ChemSpider |
| DOI | |
| Downloads | Get JSON data Get MOL2 data Get SVG Image |
| Elements | C N S O Cl |