2,5-Dichloro-4-{3-Methyl-5-Oxo-4-[(E)-(4-Sulfophenyl)Diazenyl]-4,5-Dihydro-1H-Pyrazol-1-Yl}Benzenesulfonic Acid

Molecule SVG Image

Properties Simple | Detailed

Formula C16H12Cl2N4O7S2
IUPAC Name 2,5-dichloro-4-[(4s)-3-methyl-5-oxo-4-[(e)-(4-sulfophenyl)azo]-4h-pyrazol-1-yl]benzenesulfonic acid
Molecular Mass 507.325 g·mol−1
Heat of Formation -713.3 ± 16.7 kJ·mol−1
Dipole Moment 5.63 ± 1.08 D
Volume 488.97 Å 3
Surface Area 431.68 Å 2
HOMO Energy -9.65 ± 0.55 eV
LUMO Energy -2.23 ± eV
Point Group Symmetry C1
InChIKey DWYWPBYWDAZKNX-CVTQAYBASA-N
QR Code Generate QR Code
DOI
Downloads Get JSON data Get MOL2 data Get SVG Image
Elements C Cl H O N S