Information card for entry 2235047

Structure parameters

• Chemical name: Benzyltriethylammonium tetrachloridoferrate(III)
• Formula: C13 H22 Cl4 Fe N
• Calculated formula: C13 H22 Cl4 Fe N
• Title of publication: Benzyltriethylammonium tetrachloridoferrate(III)
• Authors of publication: Jin, Lei
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2012
• Journal volume: 68
• Journal issue: 6
• Pages of publication: m805
• a: 15.514 ± 0.003 Å
• b: 15.021 ± 0.003 Å
• c: 16.155 ± 0.003 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 3764.7 ± 1.3 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 5
• Space group number: 61
• Hermann-Mauguin space group symbol: P b c a
• Hall space group symbol: -P 2ac 2ab
• Residual factor for all reflections: 0.1091
• Residual factor for significantly intense reflections: 0.0682
• Weighted residual factors for significantly intense reflections: 0.1511
• Weighted residual factors for all reflections included in the refinement: 0.1704
• Goodness-of-fit parameter for all reflections included in the refinement: 1.035
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: Yes