Information card for entry 1543879

Structure parameters

• Common name: 4FI-1
• Chemical name: BP4VA FI-1
• Formula: C20 H10 F3 I3 N
• Calculated formula: C20 H10 F3 I3 N
• Title of publication: Construction and function of a highly efficient supramolecular luminescent system.
• Authors of publication: Liu, Yingjie; Ma, Suqian; Xu, Bin; Tian, Wenjing
• Journal of publication: Faraday discussions
• Year of publication: 2017
• Journal volume: 196
• Pages of publication: 219 - 229
• a: 8.6902 ± 0.0017 Å
• b: 13.87 ± 0.003 Å
• c: 17.377 ± 0.004 Å
• α: 90°
• β: 102.8 ± 0.03°
• γ: 90°
• Cell volume: 2042.5 ± 0.8 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 5
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/c 1
• Hall space group symbol: -P 2ybc
• Residual factor for all reflections: 0.0646
• Residual factor for significantly intense reflections: 0.0462
• Weighted residual factors for significantly intense reflections: 0.1237
• Weighted residual factors for all reflections included in the refinement: 0.1414
• Goodness-of-fit parameter for all reflections included in the refinement: 1.035
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No