Information card for entry 1552226

Structure parameters

• Formula: C22 H15 F5 N2
• Calculated formula: C22 H15 F5 N2
• SMILES: Fc1c(c(F)c(F)c(F)c1F)C1=NN(c2ccc(cc2)C)C(c2ccccc2)C1
• Title of publication: Multifunctional pyrazoline based AIEgens: real-time tracking and specific protein “fishing” of lipid droplets
• Authors of publication: Zhao, Na; Li, Yan; Yang, Weiyao; Zhuang, Jiabao; Li, Yue; Li, Nan
• Journal of publication: Chemical Science
• Year of publication: 2019
• a: 11.1225 ± 0.0004 Å
• b: 12.8307 ± 0.0005 Å
• c: 13.8928 ± 0.0005 Å
• α: 100.865 ± 0.003°
• β: 91.711 ± 0.003°
• γ: 103.357 ± 0.003°
• Cell volume: 1888.83 ± 0.13 ų
• Cell temperature: 298 K
• Ambient diffraction temperature: 298 K
• Number of distinct elements: 4
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0725
• Residual factor for significantly intense reflections: 0.0614
• Weighted residual factors for significantly intense reflections: 0.1672
• Weighted residual factors for all reflections included in the refinement: 0.1799
• Goodness-of-fit parameter for all reflections included in the refinement: 1.045
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 1.54184 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No