Information card for entry 4349724

Structure parameters

• Formula: C8 H11 Cd Cl2 Co N10 S2
• Calculated formula: C8 H11 Cd Cl2 Co N10 S2
• Title of publication: Cation-templated cyanometallate-based supramolecular rectangular cage compounds showing dielectric transitions
• Authors of publication: Liu, Yu-Ling; Zhang, Wen
• Journal of publication: Inorganic Chemistry Frontiers
• Year of publication: 2017
• Journal volume: 4
• Journal issue: 8
• Pages of publication: 1304
• a: 15.0723 ± 0.0016 Å
• b: 15.0723 ± 0.0016 Å
• c: 8.6294 ± 0.0009 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 1960.4 ± 0.4 ų
• Cell temperature: 273 ± 2 K
• Ambient diffraction temperature: 273 ± 2 K
• Number of distinct elements: 7
• Space group number: 129
• Hermann-Mauguin space group symbol: P 4/n m m :2
• Hall space group symbol: -P 4a 2a
• Residual factor for all reflections: 0.0962
• Residual factor for significantly intense reflections: 0.0943
• Weighted residual factors for significantly intense reflections: 0.2432
• Weighted residual factors for all reflections included in the refinement: 0.2447
• Goodness-of-fit parameter for all reflections included in the refinement: 1.078
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No