Information card for entry 7228829

Structure parameters

• Formula: C52 H64 N4 O2 Si4
• Calculated formula: C52 H64 N4 O2 Si4
• Title of publication: Rendering cross-conjugated azophenine derivatives emissive to probe the silent photophysical properties of emeraldine
• Authors of publication: Lei, Hu; Langlois, Adam; Fortin, Daniel; Karsenti, Paul-Ludovic; Aly, Shawkat M.; Harvey, Pierre D.
• Journal of publication: Phys. Chem. Chem. Phys.
• Year of publication: 2017
• a: 38.446 ± 0.002 Å
• b: 5.7728 ± 0.0003 Å
• c: 26.2153 ± 0.0014 Å
• α: 90°
• β: 102.956 ± 0.004°
• γ: 90°
• Cell volume: 5670.1 ± 0.5 ų
• Cell temperature: 173 ± 2 K
• Ambient diffraction temperature: 173 ± 2 K
• Number of distinct elements: 5
• Space group number: 15
• Hermann-Mauguin space group symbol: C 1 2/c 1
• Hall space group symbol: -C 2yc
• Residual factor for all reflections: 0.2812
• Residual factor for significantly intense reflections: 0.1495
• Weighted residual factors for significantly intense reflections: 0.3593
• Weighted residual factors for all reflections included in the refinement: 0.4352
• Goodness-of-fit parameter for all reflections included in the refinement: 1.207
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 1.54178 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No