Information card for entry 7023921

Structure parameters

• Formula: C32 H36 N8 O10 S2 Zn2
• Calculated formula: C32 H36 N8 O10 S2 Zn2
• Title of publication: New metal-organic frameworks based on 2,5-thiophenedicarboxylate and pyridine- or imidazole-based spacers: syntheses, topological structures, and properties.
• Authors of publication: Zhou, Li; Wang, Chenggang; Zheng, Xiaofang; Tian, Zhengfang; Wen, Lili; Qu, Hua; Li, Dongfeng
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2013
• Journal volume: 42
• Journal issue: 46
• Pages of publication: 16375 - 16386
• a: 9.4224 ± 0.0007 Å
• b: 12.2481 ± 0.0009 Å
• c: 18.7629 ± 0.0014 Å
• α: 108.911 ± 0.001°
• β: 91.062 ± 0.001°
• γ: 110.102 ± 0.001°
• Cell volume: 1903 ± 0.2 ų
• Cell temperature: 296 ± 2 K
• Ambient diffraction temperature: 296 ± 2 K
• Number of distinct elements: 6
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0369
• Residual factor for significantly intense reflections: 0.031
• Weighted residual factors for significantly intense reflections: 0.1076
• Weighted residual factors for all reflections included in the refinement: 0.1297
• 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