Information card for entry 2231468

Structure parameters

• Chemical name: 4,4'-(Cyclohexane-1,1-diyl)dianilinium dichloride monohydrate
• Formula: C18 H26 Cl2 N2 O
• Calculated formula: C18 H26 Cl2 N2 O
• Title of publication: 4,4'-(Cyclohexane-1,1-diyl)dianilinium dichloride monohydrate
• Authors of publication: Qian, Hui-Fen; Huang, Wei
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2011
• Journal volume: 67
• Journal issue: 9
• Pages of publication: o2420
• a: 8.442 ± 0.003 Å
• b: 9.548 ± 0.004 Å
• c: 12.098 ± 0.005 Å
• α: 90°
• β: 107.085 ± 0.005°
• γ: 90°
• Cell volume: 932.1 ± 0.6 ų
• Cell temperature: 291 ± 2 K
• Ambient diffraction temperature: 291 ± 2 K
• Number of distinct elements: 5
• Space group number: 11
• Hermann-Mauguin space group symbol: P 1 21/m 1
• Hall space group symbol: -P 2yb
• Residual factor for all reflections: 0.0905
• Residual factor for significantly intense reflections: 0.0653
• Weighted residual factors for significantly intense reflections: 0.1892
• Weighted residual factors for all reflections included in the refinement: 0.2124
• Goodness-of-fit parameter for all reflections included in the refinement: 1.101
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes