Information card for entry 4503123

Structure parameters

• Formula: C70.67 H73.33 Cl12 Mn4 N14 Nb6 O16
• Calculated formula: C70.66 H64 Cl12 Mn4 N14 Nb6 O15.98
• Title of publication: Metal‒Ligand Directed Assembly of Layered Cluster-Based Coordination Polymer and Its Solvent-Mediated Structural Transformations
• Authors of publication: Zhang, Jian-Jun; Zhao, Yue; Gamboa, Sergio Aarón; Lachgar, Abdessadek
• Journal of publication: Crystal Growth & Design
• Year of publication: 2008
• Journal volume: 8
• Journal issue: 1
• Pages of publication: 172 - 175
• a: 14.949 ± 0.004 Å
• b: 13.373 ± 0.004 Å
• c: 22.736 ± 0.006 Å
• α: 90°
• β: 94.409 ± 0.004°
• γ: 90°
• Cell volume: 4532 ± 2 ų
• Cell temperature: 193 ± 2 K
• Ambient diffraction temperature: 193 ± 2 K
• Number of distinct elements: 7
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/c 1
• Hall space group symbol: -P 2ybc
• Residual factor for all reflections: 0.0671
• Residual factor for significantly intense reflections: 0.0473
• Weighted residual factors for significantly intense reflections: 0.0954
• Weighted residual factors for all reflections included in the refinement: 0.1028
• Goodness-of-fit parameter for all reflections included in the refinement: 1.056
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No