Information card for entry 7101598

Structure parameters

• Formula: C168 H188 Cd16 N8 O118
• Calculated formula: C168 H188 Cd16 N8 O118
• Title of publication: Coexistence of chiral hydrophilic and achiral hydrophobic channels in one multi-helical-array metal–organic framework incorporating helical water cluster chains
• Authors of publication: Zang, Shuangquan; Su, Yang; Duan, Chunying; Li, Yizhi; Zhu, Huizhen; Meng, Qingjin
• Journal of publication: Chemical Communications (Cambridge, United Kingdom)
• Year of publication: 2006
• Journal issue: 48
• Pages of publication: 4997 - 4999
• a: 40.698 ± 0.002 Å
• b: 40.698 ± 0.002 Å
• c: 13.5231 ± 0.001 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 22399 ± 2 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 5
• Space group number: 88
• Hermann-Mauguin space group symbol: I 41/a :2
• Hall space group symbol: -I 4ad
• Residual factor for all reflections: 0.0717
• Residual factor for significantly intense reflections: 0.0535
• Weighted residual factors for significantly intense reflections: 0.1276
• Weighted residual factors for all reflections included in the refinement: 0.1344
• Goodness-of-fit parameter for all reflections included in the refinement: 1.084
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No