Information card for entry 4117936

Structure parameters

• Formula: C132 H172 Cd4 N12 Ni4 O32
• Calculated formula: C132 H162 Cd4 N12 Ni4 O32
• Title of publication: Chiral Nanoporous Metal-Metallosalen Frameworks for Hydrolytic Kinetic Resolution of Epoxides
• Authors of publication: Chengfeng Zhu; Guozan Yuan; Xu Chen; Zhiwei Yang; Yong Cui
• Journal of publication: Journal of the American Chemical Society
• Year of publication: 2012
• Journal volume: 134
• Pages of publication: 8058 - 8061
• a: 14.43 ± 0.003 Å
• b: 40.91 ± 0.009 Å
• c: 30.645 ± 0.006 Å
• α: 90°
• β: 101.996 ± 0.003°
• γ: 90°
• Cell volume: 17696 ± 6 ų
• Cell temperature: 123 ± 2 K
• Ambient diffraction temperature: 123 ± 2 K
• Number of distinct elements: 6
• Space group number: 5
• Hermann-Mauguin space group symbol: C 1 2 1
• Hall space group symbol: C 2y
• Residual factor for all reflections: 0.1838
• Residual factor for significantly intense reflections: 0.1072
• Weighted residual factors for significantly intense reflections: 0.2559
• Weighted residual factors for all reflections included in the refinement: 0.3104
• Goodness-of-fit parameter for all reflections included in the refinement: 0.996
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No