Information card for entry 2002092

Structure parameters

• Formula: C8 H12 Cl6 Fe2 N4
• Calculated formula: C8 H12 Cl6 Fe2 N4
• Title of publication: FeCl~3~ behavior in acetonitrile: structures of [FeCl~2~(CH~3~CN)~4~][FeCl~4~] and [AlCl(CH~3~CN)~5~][FeCl~4~]~2~.CH~3~CN
• Authors of publication: Gao, Y.; Guery, J.; Jacoboni, C.
• Journal of publication: Acta Crystallographica Section C
• Year of publication: 1993
• Journal volume: 49
• Journal issue: 1
• Pages of publication: 147 - 151
• a: 13.467 ± 0.001 Å
• b: 14.879 ± 0.001 Å
• c: 10.1125 ± 0.0008 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 2026.3 ± 0.3 ų
• Cell temperature: 293 K
• Ambient diffraction temperature: 293 K
• Number of distinct elements: 5
• Space group number: 33
• Hermann-Mauguin space group symbol: P n a 21
• Hall space group symbol: P 2c -2n
• Residual factor for significantly intense reflections: 0.035
• Weighted residual factors for significantly intense reflections: 0.035
• Goodness-of-fit parameter for significantly intense reflections: 1.38
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No