Information card for entry 7237706

Structure parameters

• Chemical name: C-2
• Formula: C40 H28 N2
• Calculated formula: C40 H28 N2
• Title of publication: Luminescent switching and structural transition through multiple external stimuli based on organic molecular polymorphs
• Authors of publication: Shao, Bo; Jin, Rihua; Li, Aisen; Liu, Yingjie; Li, Bao; Xu, Shuping; Xu, Weiqing; Xu, Bin; Tian, Wenjing
• Journal of publication: Journal of Materials Chemistry C
• Year of publication: 2019
• Journal volume: 7
• Journal issue: 11
• Pages of publication: 3263
• a: 9.3582 ± 0.0019 Å
• b: 32.856 ± 0.007 Å
• c: 9.3637 ± 0.0019 Å
• α: 90°
• β: 106.42 ± 0.03°
• γ: 90°
• Cell volume: 2761.7 ± 1.1 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: 0.095
• Residual factor for significantly intense reflections: 0.0849
• Weighted residual factors for significantly intense reflections: 0.2413
• Weighted residual factors for all reflections included in the refinement: 0.2524
• Goodness-of-fit parameter for all reflections included in the refinement: 1.025
• Diffraction radiation wavelength: 1.54178 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No