Information card for entry 4333994

Structure parameters

• Formula: C25 H46 Cd N8 O16
• Calculated formula: C25 H34 Cd N8 O16
• Title of publication: Three-Dimensional Zinc(II) and Cadmium(II) Coordination Frameworks with N,N,N',N'-Tetrakis(pyridin-4-yl)methanediamine: Structure, Photoluminescence, and Catalysis
• Authors of publication: Jong Won Shin; Jeong Mi Bae; Cheal Kim; Kil Sik Min
• Journal of publication: Inorganic Chemistry
• Year of publication: 2013
• Journal volume: 52
• Pages of publication: 2265 - 2267
• a: 16.3137 ± 0.001 Å
• b: 13.3549 ± 0.0008 Å
• c: 17.2465 ± 0.0011 Å
• α: 90°
• β: 115.163 ± 0.001°
• γ: 90°
• Cell volume: 3400.9 ± 0.4 ų
• Cell temperature: 200 ± 2 K
• Ambient diffraction temperature: 200 ± 2 K
• Number of distinct elements: 5
• Space group number: 15
• Hermann-Mauguin space group symbol: C 1 2/c 1
• Hall space group symbol: -C 2yc
• Residual factor for all reflections: 0.1199
• Residual factor for significantly intense reflections: 0.0754
• Weighted residual factors for significantly intense reflections: 0.1706
• Weighted residual factors for all reflections included in the refinement: 0.2056
• Goodness-of-fit parameter for all reflections included in the refinement: 1.122
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No