Information card for entry 7227325

Structure parameters

• Chemical name: poly-[dimethylammonium μ~6~-(((adamantane-1,3,5-triyl)- -tri(phen-4-yl))-tri-(carboxylato-κ^2^O,O'))- -(N,N-dimethylformamide-κO)-cadmium(II)],solvate with N,N-dimethylformamide and water
• Formula: C36 H44 Cd N2 O9
• Calculated formula: C37.5 H25 Cd N1.5 O8.5
• Title of publication: A view on systematic truncation of tetrahedral ligands for coordination polymers
• Authors of publication: Zhao, Tian; Heering, Christian; Boldog, Ishtvan; Domasevitch, Konstantin V.; Janiak, Christoph
• Journal of publication: CrystEngComm
• Year of publication: 2017
• Journal volume: 19
• Journal issue: 5
• Pages of publication: 776
• a: 11.0682 ± 0.0004 Å
• b: 13.5036 ± 0.0005 Å
• c: 14.6691 ± 0.0005 Å
• α: 70.055 ± 0.002°
• β: 79.314 ± 0.002°
• γ: 87.896 ± 0.002°
• Cell volume: 2024.37 ± 0.13 ų
• Cell temperature: 296 ± 2 K
• Ambient diffraction temperature: 296 ± 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: 0.091
• Residual factor for significantly intense reflections: 0.0713
• Weighted residual factors for significantly intense reflections: 0.2032
• Weighted residual factors for all reflections included in the refinement: 0.2217
• Goodness-of-fit parameter for all reflections included in the refinement: 1.073
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No