Information card for entry 7207206

Structure parameters

• Common name: poly(tricadmium bis(1,2-bis(imidazol-1'-yl)ethane) (1,4- bis((pyridinium-4-carboxylate)methyl)benzene) (u-Br)tetrabromide bis(N,N-Dimethylformamide))
• Formula: C21 H25 Br3 Cd1.5 N6 O3
• Calculated formula: C21 H25 Br3 Cd1.5 N6 O3
• Title of publication: Two novel 2D cadmium(ii) MOFs based on flexible bis(imidazolyl) and zwitterionic dicarboxylate ligands
• Authors of publication: Li, Xiaoju; Guo, Xiaofang; Weng, XiuLan; Lin, Shen
• Journal of publication: CrystEngComm
• Year of publication: 2012
• Journal volume: 14
• Journal issue: 4
• Pages of publication: 1412
• a: 8.031 ± 0.002 Å
• b: 8.682 ± 0.002 Å
• c: 19.335 ± 0.005 Å
• α: 98.961 ± 0.006°
• β: 93.476 ± 0.011°
• γ: 99.983 ± 0.007°
• Cell volume: 1306.2 ± 0.6 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 6
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0351
• Residual factor for significantly intense reflections: 0.0283
• Weighted residual factors for significantly intense reflections: 0.0685
• Weighted residual factors for all reflections included in the refinement: 0.0721
• Goodness-of-fit parameter for all reflections included in the refinement: 1.03
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No