Solvatochromic and single crystal studies of 3-(4-bromophenyl)-5-phenyl-4,5-dihydro-1H-pyrazole-1-carbaldehyde

Spectrochim Acta A Mol Biomol Spectrosc. 2013 Apr 15:107:213-7. doi: 10.1016/j.saa.2012.12.086. Epub 2013 Jan 17.

Abstract

The structure of 3-(4-bromophenyl)-5-phenyl-4,5-dihydro-1H-pyrazole-1-carbaldehyde was determined by using X-ray diffraction analysis. Photophysical studies of the title compound were investigated in the solvents with different polarities. The emission spectrum of the compound was recorded in polar solvent DMSO (356 nm). In different solvents the extinction coefficients and quantum yield of the compound vary from 1.88×10(4) to 3.53×10(4) and 0.01 to 0.25, respectively. The ratio of the dipole moment of excited state to the dipole moment of ground state was calculated by using solvatochromic shift methods.

MeSH terms

  • Aldehydes / chemical synthesis
  • Aldehydes / chemistry*
  • Crystallography, X-Ray
  • Dimethyl Sulfoxide / chemistry
  • Halogenation
  • Models, Molecular
  • Pyrazoles / chemical synthesis
  • Pyrazoles / chemistry*
  • Solvents / chemistry
  • Spectrometry, Fluorescence

Substances

  • Aldehydes
  • Pyrazoles
  • Solvents
  • Dimethyl Sulfoxide