Information card for entry 2208679

Structure parameters

• Common name: Copper(II) chlorofumarate trihydrate
• Chemical name: catena-poly[[[diaquacopper(II)]-μ-chlorofumarato-κO,O'] hydrate]
• Formula: C4 H7 Cl Cu O7
• Calculated formula: C4 H6 Cl Cu O7
• Title of publication: Copper(II) chlorofumarate trihydrate
• Authors of publication: Billetter, Heinrich; Pantenburg, Ingo; Ruschewitz, Uwe
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2006
• Journal volume: 62
• Journal issue: 4
• Pages of publication: m881 - m883
• a: 14.849 ± 0.003 Å
• b: 7.1407 ± 0.0006 Å
• c: 8.7237 ± 0.0015 Å
• α: 90°
• β: 113.751 ± 0.013°
• γ: 90°
• Cell volume: 846.7 ± 0.3 ų
• Cell temperature: 170 ± 2 K
• Ambient diffraction temperature: 170 ± 2 K
• Number of distinct elements: 5
• Space group number: 12
• Hermann-Mauguin space group symbol: C 1 2/m 1
• Hall space group symbol: -C 2y
• Residual factor for all reflections: 0.0337
• Residual factor for significantly intense reflections: 0.0305
• Weighted residual factors for significantly intense reflections: 0.0776
• Weighted residual factors for all reflections included in the refinement: 0.0793
• Goodness-of-fit parameter for all reflections included in the refinement: 1.069
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes