Information card for entry 2203393

Structure parameters

• Chemical name: Aquabis(tetrahydrofuran)hexakis(trifluoroacetato)oxocopper(II)diiron(III)
• Formula: C20 H18 Cu F18 Fe2 O16
• Calculated formula: C20 H18 Cu0.999 F18 Fe2.001 O16
• Title of publication: Aquabis(tetrahydrofuran)hexakis(trifluoroacetato)(μ~3~-oxo)copper(II)diiron(III)
• Authors of publication: Amini, Mostafa M.; Yadavi, Marzieh; Ng, Seik Weng
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2004
• Journal volume: 60
• Journal issue: 4
• Pages of publication: m492 - m494
• a: 9.1773 ± 0.0006 Å
• b: 12.8141 ± 0.0008 Å
• c: 16.377 ± 0.001 Å
• α: 96.216 ± 0.001°
• β: 105.78 ± 0.001°
• γ: 99.425 ± 0.001°
• Cell volume: 1804.5 ± 0.2 ų
• Cell temperature: 163 ± 2 K
• Ambient diffraction temperature: 163 ± 2 K
• Number of distinct elements: 6
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0537
• Residual factor for significantly intense reflections: 0.0386
• Weighted residual factors for significantly intense reflections: 0.0989
• Weighted residual factors for all reflections included in the refinement: 0.1093
• Goodness-of-fit parameter for all reflections included in the refinement: 1.004
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No