Information card for entry 2205736

Structure parameters

• Chemical name: [4-(2,2-Diphenyl-vinyl)-phenyl]-diphenyl- amine. n-hexane(1/0.25)
• Formula: C33.5 H28.5 N
• Calculated formula: C33.5 H28.5 N
• Title of publication: [4-(2,2-Diphenylvinyl)phenyl]diphenylamine <i>n</i>-hexane 0.25 solvate
• Authors of publication: Chu, Ji-Cheng; Li, Wei; Liu, Dong-Zhi; Cao, Xiao-Dan
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2005
• Journal volume: 61
• Journal issue: 5
• Pages of publication: o1372 - o1373
• a: 13.228 ± 0.009 Å
• b: 19.64 ± 0.014 Å
• c: 11.524 ± 0.008 Å
• α: 90°
• β: 114.024 ± 0.011°
• γ: 90°
• Cell volume: 2735 ± 3 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 3
• 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: 0.122
• Residual factor for significantly intense reflections: 0.0687
• Weighted residual factors for significantly intense reflections: 0.2033
• Weighted residual factors for all reflections included in the refinement: 0.2434
• Goodness-of-fit parameter for all reflections included in the refinement: 1.092
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: Yes