Information card for entry 7110753

Structure parameters

• Chemical name: [C66 H48 F36 Fe2 Mn3 N20 O12]n
• Formula: C66 H48 F36 Fe2 Mn3 N20 O12
• Calculated formula: C66 H48 F36 Fe2 Mn3 N20 O12
• Title of publication: A polymeric, layered bimetallic Mn(ii)Fe(iii) imidazolate network; crystal structure and magnetic properties
• Authors of publication: Lambert, François; Renault, Jean-Philippe; Policar, Clotilde; Morgenstern-Badarau, Irène; Cesario, Michèle
• Journal of publication: Chemical Communications
• Year of publication: 2000
• Journal issue: 1
• Pages of publication: 35
• a: 18.328 ± 0.009 Å
• b: 18.328 ± 0.009 Å
• c: 48.798 ± 0.02 Å
• α: 90°
• β: 90°
• γ: 120°
• Cell volume: 14196 ± 11 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 7
• Space group number: 167
• Hermann-Mauguin space group symbol: R -3 c :H
• Hall space group symbol: -R 3 2"c
• Residual factor for all reflections: 0.1089
• Residual factor for significantly intense reflections: 0.0624
• Weighted residual factors for all reflections: 0.1823
• Weighted residual factors for all reflections included in the refinement: 0.1514
• Goodness-of-fit parameter for all reflections: 0.93
• Goodness-of-fit parameter for all reflections included in the refinement: 1.061
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No