Information card for entry 7126152

Structure parameters

• Formula: C19 H33 F6 N2 O9 P
• Calculated formula: C19 H33 F6 N2 O9 P
• Title of publication: Enhancing switchable dielectric property for crystalline supramolecular rotor compounds by adding polar components.
• Authors of publication: Huang, Rui-Kang; Chen, Xiao-Xian; Xiao, Zhi-Feng; Liu, De-Xuan; Zhang, Wei-Xiong; Chen, Xiao-Ming
• Journal of publication: Chemical communications (Cambridge, England)
• Year of publication: 2020
• Journal volume: 56
• Journal issue: 29
• Pages of publication: 4114 - 4117
• a: 16.774 ± 0.003 Å
• b: 20 ± 0.003 Å
• c: 15.122 ± 0.003 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 5073.1 ± 1.6 ų
• Cell temperature: 213 ± 2 K
• Ambient diffraction temperature: 213 K
• Number of distinct elements: 6
• Space group number: 56
• Hermann-Mauguin space group symbol: P c c n
• Hall space group symbol: -P 2ab 2ac
• Residual factor for all reflections: 0.056
• Residual factor for significantly intense reflections: 0.0536
• Weighted residual factors for significantly intense reflections: 0.1531
• Weighted residual factors for all reflections included in the refinement: 0.1568
• Goodness-of-fit parameter for all reflections included in the refinement: 1.098
• Diffraction radiation wavelength: 1.54178 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No