Information card for entry 3500083

Structure parameters

• Common name: tetrahexylammonium iodide
• Formula: C24 H52 I N
• Calculated formula: C24 H52 I N
• Title of publication: Tetrahexylammonium Iodide
• Authors of publication: Thierry Maris
• Journal of publication: Personal communication to COD
• Year of publication: 2019
• a: 10.0773 ± 0.0011 Å
• b: 10.0124 ± 0.0011 Å
• c: 26.219 ± 0.003 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 2645.4 ± 0.5 ų
• Cell temperature: 150 K
• Ambient diffraction temperature: 150 K
• Number of distinct elements: 4
• Space group number: 41
• Hermann-Mauguin space group symbol: A e a 2
• Hall space group symbol: A 2 -2ab
• Residual factor for all reflections: 0.0689
• Residual factor for significantly intense reflections: 0.0603
• Weighted residual factors for significantly intense reflections: 0.1736
• Weighted residual factors for all reflections included in the refinement: 0.1833
• Goodness-of-fit parameter for all reflections included in the refinement: 1.173
• Diffraction radiation wavelength: 1.54178 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes