Information card for entry 7237089

Structure parameters

• Formula: C5 H8 Cu O5
• Calculated formula: C5 H8 Cu O5
• Title of publication: Magnetostructural relationships in polymorphic ethylmalonate-containing copper(ii) coordination polymers
• Authors of publication: Pasán, Jorge; Sanchiz, Joaquín; Lloret, Francesc; Julve, Miguel; Ruiz-Pérez, Catalina
• Journal of publication: CrystEngComm
• Year of publication: 2018
• Journal volume: 20
• Journal issue: 46
• Pages of publication: 7464
• a: 9.77 ± 0.003 Å
• b: 9.921 ± 0.003 Å
• c: 14.477 ± 0.003 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 1403.2 ± 0.7 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 4
• Space group number: 41
• Hermann-Mauguin space group symbol: C 2 e b
• Hall space group symbol: C -2ac 2
• Residual factor for all reflections: 0.0759
• Residual factor for significantly intense reflections: 0.0458
• Weighted residual factors for significantly intense reflections: 0.0894
• Weighted residual factors for all reflections included in the refinement: 0.098
• Goodness-of-fit parameter for all reflections included in the refinement: 1.031
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No