Information card for entry 7115969

Structure parameters

• Formula: C216 H96 N48 Ni18 O156
• Calculated formula: C216 H96 N48 Ni18 O156
• Title of publication: Two nanocage anionic metal-organic frameworks with rht topology and {[M(H2O)6]6}12+ charge aggregation for rapid and selective adsorption of cationic dyes
• Authors of publication: Zhifeng Zhu; Yue-Ling Bai; Liangliang Zhang; Daofeng Sun; Jianhui Fang; Shourong Zhu
• Journal of publication: Chem.Commun.
• Year of publication: 2014
• Journal volume: 50
• Pages of publication: 14674
• a: 39.7164 ± 0.0008 Å
• b: 39.7164 ± 0.0008 Å
• c: 39.7164 ± 0.0008 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 62648 ± 2 ų
• Cell temperature: 140 ± 2 K
• Ambient diffraction temperature: 140 ± 2 K
• Number of distinct elements: 5
• Space group number: 225
• Hermann-Mauguin space group symbol: F m -3 m
• Hall space group symbol: -F 4 2 3
• Residual factor for all reflections: 0.0988
• Residual factor for significantly intense reflections: 0.0826
• Weighted residual factors for significantly intense reflections: 0.2577
• Weighted residual factors for all reflections included in the refinement: 0.265
• Goodness-of-fit parameter for all reflections included in the refinement: 1.071
• Diffraction radiation wavelength: 1.54184 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No