Information card for entry 4513500

Structure parameters

• Formula: C32 H44 Br2 N6
• Calculated formula: C32 H44 Br2 N6
• Title of publication: Azobenzene-Based Organic Salts with Ionic Liquid and Liquid Crystalline Properties
• Authors of publication: Stappert, Kathrin; Muthmann, Johanna; Spielberg, Eike T.; Mudring, Anja-Verena
• Journal of publication: Crystal Growth & Design
• Year of publication: 2015
• Journal volume: 15
• Journal issue: 9
• Pages of publication: 4701
• a: 14.98 ± 0.002 Å
• b: 8.487 ± 0.0011 Å
• c: 13.59 ± 0.002 Å
• α: 90°
• β: 107.124 ± 0.002°
• γ: 90°
• Cell volume: 1651.2 ± 0.4 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 4
• 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: 0.0674
• Residual factor for significantly intense reflections: 0.0431
• Weighted residual factors for significantly intense reflections: 0.0951
• Weighted residual factors for all reflections included in the refinement: 0.1255
• Goodness-of-fit parameter for all reflections included in the refinement: 1.132
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No