Information card for entry 7009762

Structure parameters

• Formula: C24 H17 Cd N2 O4.5 S2
• Calculated formula: C24 H17 Cd N2 O4.5 S2
• Title of publication: Towards rational synthesis of polar solids. Synthesis and X-ray structures of cadmium(II) meta-pyridinecarboxylate coordination polymers †
• Authors of publication: Evans, Owen R.; Lin, Wenbin
• Journal of publication: Journal of the Chemical Society, Dalton Transactions
• Year of publication: 2000
• Journal issue: 21
• Pages of publication: 3949
• a: 15.0989 ± 0.0007 Å
• b: 20.3404 ± 0.001 Å
• c: 15.1155 ± 0.0007 Å
• α: 90°
• β: 97.982 ± 0.001°
• γ: 90°
• Cell volume: 4597.3 ± 0.4 ų
• Cell temperature: 173 ± 2 K
• Ambient diffraction temperature: 173 ± 2 K
• Number of distinct elements: 6
• 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: 0.1245
• Residual factor for significantly intense reflections: 0.0611
• Weighted residual factors for significantly intense reflections: 0.1415
• Weighted residual factors for all reflections included in the refinement: 0.1615
• Goodness-of-fit parameter for all reflections included in the refinement: 1.023
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No