Acta Crystallographica Section E Structure Reports Online · 2006 · 18 citations · 6 references
Natural SciencesChemistryPhysicsCrystal StructureOrganic ChemistrySolid-state ChemistryCoordination ChemistryCrystal ChemistryCrystal LatticeCrystal SymmetryCrystallographyMolecular SymmetryDihedral AngleDihedral EffectHarmonic GenerationNonlinear Optical PropertiesOptical PropertiesSecond Harmonic Generation SpectroscopySecond-harmonic Generation
The title compound, C14H14NO+·C6H4BrSO3−, (I), crystallizes in a non-centrosymmetric space group and exhibits non-linear optical properties. The second-harmonic generation (SHG) effect of (I) is about 0.14 times that of urea. The cation is almost planar and exists in an E configuration. The pyridinium and benzene rings of the cation make a dihedral angle of 4.52 (8)°. The dihedral angles between the benzene ring of the anion and the mean planes through the pyridinium and benzene rings of the cation are 67.06 (8) and 71.56 (8)°, respectively. In the crystal structure, the cations and anions are linked by O—H⋯O hydrogen bonds and weak C—H⋯O interactions into a three-dimensional network. C—H⋯π interactions are also observed in the crystal structure.
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On enantiomorph-polarity estimation
H. D. Flack · Acta Crystallographica Section A Foundations of Crystallography · 1983 · 10.4K citations
Natural Sciences, Chemistry, Physics +10
Molecular design on substituted DAST derivatives for second-order nonlinear optics
Hirohito Umezawa, Kyoko TSUJI, Shuji Okada et al. · Optical Materials · 2002 · 36 citations
Natural Sciences, Chemistry, Physics +14