Information card for entry 7124979

Structure parameters

• Formula: C127 H139 Cd2 Cr4 N8 Na5 O42
• Calculated formula: C127 H139 Cd2 Cr4 N8 Na5 O42
• Title of publication: A Cr(salen)-based metal-organic framework as a versatile catalyst for efficient asymmetric transformations.
• Authors of publication: Xia, Qingchun; Liu, Yan; Li, Zijian; Gong, Wei; Cui, Yong
• Journal of publication: Chemical communications (Cambridge, England)
• Year of publication: 2016
• Journal volume: 52
• Journal issue: 89
• Pages of publication: 13167 - 13170
• a: 40.623 ± 0.002 Å
• b: 41.321 ± 0.002 Å
• c: 51.868 ± 0.003 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 87065 ± 8 ų
• Cell temperature: 116 ± 2 K
• Ambient diffraction temperature: 116.15 K
• Number of distinct elements: 7
• Space group number: 22
• Hermann-Mauguin space group symbol: F 2 2 2
• Hall space group symbol: F 2 2
• Residual factor for all reflections: 0.1186
• Residual factor for significantly intense reflections: 0.065
• Weighted residual factors for significantly intense reflections: 0.1767
• Weighted residual factors for all reflections included in the refinement: 0.2161
• Goodness-of-fit parameter for all reflections included in the refinement: 1.01
• Diffraction radiation wavelength: 1.54178 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No