Information card for entry 7060760

Structure parameters

• Chemical name: 1,3-Dimethyl-1H-benzimidazol-3-ium tetrachloro-iron(iii)
• Formula: C9 H11 Cl4 Fe N2
• Calculated formula: C9 H11 Cl4 Fe N2
• Title of publication: Synthesis, structural analysis, electrochemical and magnetic properties of tetrachloroferrate ionic liquids
• Authors of publication: Zafar, Anham; Imtiaz-ud-Din.,; Ahmed, Safeer; Bučar, Dejan-Krešimir; Tahir, Muhammad Nawaz; Palgrave, Robert G.
• Journal of publication: New Journal of Chemistry
• Year of publication: 2021
• Journal volume: 45
• Journal issue: 30
• Pages of publication: 13429 - 13440
• a: 7.3345 ± 0.0005 Å
• b: 15.4892 ± 0.001 Å
• c: 12.8785 ± 0.0007 Å
• α: 90°
• β: 100.608 ± 0.002°
• γ: 90°
• Cell volume: 1438.06 ± 0.16 ų
• Cell temperature: 296 ± 2 K
• Ambient diffraction temperature: 296 ± 2 K
• Number of distinct elements: 5
• 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: 0.0504
• Residual factor for significantly intense reflections: 0.0336
• Weighted residual factors for significantly intense reflections: 0.0825
• Weighted residual factors for all reflections included in the refinement: 0.0925
• Goodness-of-fit parameter for all reflections included in the refinement: 1.02
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No