Information card for entry 7108465

Structure parameters

• Formula: C64 H73 Cd3 N3 O24
• Calculated formula: C64 H73 Cd3 N3 O24
• Title of publication: Chiral transformations of achiral porous metal-organic frameworks via a stepwise approach
• Authors of publication: Fei-Yan Yi; Jian Zhang; Hai-Xia Zhang; Zhong-Ming Sun
• Journal of publication: Chem.Commun.
• Year of publication: 2012
• Journal volume: 48
• Pages of publication: 10419
• a: 11.287 ± 0.005 Å
• b: 15.825 ± 0.006 Å
• c: 23.361 ± 0.009 Å
• α: 102.135 ± 0.006°
• β: 101.692 ± 0.006°
• γ: 90.413 ± 0.007°
• Cell volume: 3989 ± 3 ų
• Cell temperature: 273 ± 2 K
• Ambient diffraction temperature: 273 ± 2 K
• Number of distinct elements: 5
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.1968
• Residual factor for significantly intense reflections: 0.0973
• Weighted residual factors for significantly intense reflections: 0.255
• Weighted residual factors for all reflections included in the refinement: 0.3175
• Goodness-of-fit parameter for all reflections included in the refinement: 1.011
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No