Information card for entry 7215401

Structure parameters

• Formula: C8 H16 Na2 O20 S2 Zn3
• Calculated formula: C8 H16 Na2 O20 S2 Zn3
• Title of publication: New heterometallic frameworks with flexible sulfonate-carboxylate ligand: syntheses, structures, and properties
• Authors of publication: Liu, Qing-Yan; Li, Li-Qin; Wang, Yu-Ling; Yang, Er-Ler; Wei, Jia-Jia; Fu, Jiang-Hong
• Journal of publication: CrystEngComm
• Year of publication: 2011
• Journal volume: 13
• Journal issue: 20
• Pages of publication: 6150
• a: 11.1225 ± 0.0017 Å
• b: 6.2139 ± 0.001 Å
• c: 15.089 ± 0.002 Å
• α: 90°
• β: 94.651 ± 0.002°
• γ: 90°
• Cell volume: 1039.4 ± 0.3 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/n 1
• Hall space group symbol: -P 2yn
• Residual factor for all reflections: 0.0398
• Residual factor for significantly intense reflections: 0.0285
• Weighted residual factors for significantly intense reflections: 0.0664
• Weighted residual factors for all reflections included in the refinement: 0.072
• 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