Information card for entry 7218059

Structure parameters

• Formula: C27 H34 Cd N12 O7
• Calculated formula: C27 H34 Cd N12 O7
• Title of publication: Anion-dependent assemblies of a series of Cd(ii) coordination complexes based on an asymmetric multi-dentate ligand and inorganic SBUs: syntheses, crystal structures, and fluorescent properties
• Authors of publication: Liang, Guorui; Liu, Yaru; Zhang, Xiao; Yi, Zhihui
• Journal of publication: CrystEngComm
• Year of publication: 2014
• Journal volume: 16
• Journal issue: 42
• Pages of publication: 9896
• a: 26.5918 ± 0.0009 Å
• b: 13.5595 ± 0.0005 Å
• c: 18.1128 ± 0.0006 Å
• α: 90°
• β: 94.582 ± 0.003°
• γ: 90°
• Cell volume: 6510.1 ± 0.4 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 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: 0.0688
• Residual factor for significantly intense reflections: 0.0483
• Weighted residual factors for significantly intense reflections: 0.1063
• Weighted residual factors for all reflections included in the refinement: 0.1193
• Goodness-of-fit parameter for all reflections included in the refinement: 1.05
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No