Information card for entry 1560428

Structure parameters

• Formula: C18 H14 Cd2 N4 O12 S
• Calculated formula: C18 H14 Cd2 N4 O12 S
• Title of publication: Seven new Zn(II)/Cd(II) coordination polymers with 2-(hydroxymethyl)-1 H -benzo[ d ]imidazole-5-carboxylic acid: Synthesis, structures and properties
• Authors of publication: Wang, Xin-Fang; Zhou, Sheng-Bin; Du, Ceng-Ceng; Wang, Duo-Zhi; Jia, Dianzeng
• Journal of publication: Journal of Solid State Chemistry
• Year of publication: 2017
• Journal volume: 252
• Pages of publication: 72 - 85
• a: 13.9427 ± 0.0005 Å
• b: 11.0333 ± 0.0004 Å
• c: 7.3723 ± 0.0003 Å
• α: 90°
• β: 100.215 ± 0.001°
• γ: 90°
• Cell volume: 1116.13 ± 0.07 ų
• Cell temperature: 296 ± 2 K
• Ambient diffraction temperature: 296 ± 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: 0.1177
• Residual factor for significantly intense reflections: 0.0575
• Weighted residual factors for significantly intense reflections: 0.292
• Weighted residual factors for all reflections included in the refinement: 0.292
• Goodness-of-fit parameter for all reflections included in the refinement: 1.015
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No