Information card for entry 7205273

Structure parameters

• Formula: C4 H7.5 Cd2.25 O8 S0.5
• Calculated formula: C4 H7.5 Cd2.25 O8 S0.5
• Title of publication: Metal‒organic frameworks based on transition-metal carboxylate clusters as secondary building units: synthesis, structures and properties
• Authors of publication: Zhao, Li-Min; Zhang, Zhen-Jie; Zhang, Shi-Yuan; Cui, Ping; Shi, Wei; Zhao, Bin; Cheng, Peng; Liao, Dai-Zheng; Yan, Shi-Ping
• Journal of publication: CrystEngComm
• Year of publication: 2011
• Journal volume: 13
• Journal issue: 3
• Pages of publication: 907
• a: 25.0558 ± 0.0007 Å
• b: 6.88418 ± 0.00018 Å
• c: 11.5251 ± 0.0003 Å
• α: 90°
• β: 108.977 ± 0.003°
• γ: 90°
• Cell volume: 1879.9 ± 0.09 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 5
• Space group number: 12
• Hermann-Mauguin space group symbol: C 1 2/m 1
• Hall space group symbol: -C 2y
• Residual factor for all reflections: 0.0266
• Residual factor for significantly intense reflections: 0.0237
• Weighted residual factors for significantly intense reflections: 0.0564
• Weighted residual factors for all reflections included in the refinement: 0.0574
• Goodness-of-fit parameter for all reflections included in the refinement: 1.057
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No