Information card for entry 7237704

Structure parameters

• Chemical name: C-1
• 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: 9.4994 ± 0.0003 Å
• b: 9.8382 ± 0.0003 Å
• c: 16.5464 ± 0.0005 Å
• α: 95.704 ± 0.001°
• β: 102.599 ± 0.001°
• γ: 110.032 ± 0.001°
• Cell volume: 1392.04 ± 0.08 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 3
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.1437
• Residual factor for significantly intense reflections: 0.065
• Weighted residual factors for significantly intense reflections: 0.1265
• Weighted residual factors for all reflections included in the refinement: 0.1589
• Goodness-of-fit parameter for all reflections included in the refinement: 1.012
• Diffraction radiation wavelength: 0.71076 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No