Information card for entry 4502195

Structure parameters

• Formula: C70 H68 Cd2 Fe2 N8 O14
• Calculated formula: C70 H68 Cd2 Fe2 N8 O14
• Title of publication: Secondary Ligand-Directed Assembly of CdIICoordination Architectures: From 0D to 3D Complexes Based on Ferrocenyl Carboxylate
• Authors of publication: Shi, Xianju; Wang, Xia; Li, Linke; Hou, Hongwei; Fan, Yaoting
• Journal of publication: Crystal Growth & Design
• Year of publication: 2010
• Journal volume: 10
• Journal issue: 6
• Pages of publication: 2490
• a: 10.238 ± 0.002 Å
• b: 12.877 ± 0.003 Å
• c: 13.513 ± 0.003 Å
• α: 76.38 ± 0.03°
• β: 88.99 ± 0.03°
• γ: 89.68 ± 0.03°
• Cell volume: 1731.1 ± 0.7 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 6
• Space group number: 1
• Hermann-Mauguin space group symbol: P 1
• Hall space group symbol: P 1
• Residual factor for all reflections: 0.0672
• Residual factor for significantly intense reflections: 0.0585
• Weighted residual factors for significantly intense reflections: 0.1379
• Weighted residual factors for all reflections included in the refinement: 0.1521
• Goodness-of-fit parameter for all reflections included in the refinement: 1.094
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No