Information card for entry 2019014

Structure parameters

• Chemical name: Poly[diaquatetra-μ~2~-chlorido-[μ~2~-2,2'-(piperazine-1,4-diium-1,4-diyl)diacetate]dicadmium(II)]
• Formula: C8 H18 Cd2 Cl4 N2 O6
• Calculated formula: C8 H18 Cd2 Cl4 N2 O6
• Title of publication: A novel two-dimensional coordination polymer: poly[diaquatetra-μ~2~-chlorido-[μ~2~-2,2'-(piperazine-1,4-diium-1,4-diyl)diacetate]dicadmium(II)]
• Authors of publication: Xu, Xiao-Juan; Miao, Jian-Yun; Wang, Jun
• Journal of publication: Acta Crystallographica Section C
• Year of publication: 2013
• Journal volume: 69
• Journal issue: 6
• Pages of publication: 620 - 623
• a: 8.7426 ± 0.0011 Å
• b: 14.3464 ± 0.0019 Å
• c: 7.2686 ± 0.001 Å
• α: 90°
• β: 110.808 ± 0.002°
• γ: 90°
• Cell volume: 852.2 ± 0.2 ų
• Cell temperature: 153 ± 2 K
• Ambient diffraction temperature: 153 ± 2 K
• Number of distinct elements: 6
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/c 1
• Hall space group symbol: -P 2ybc
• Residual factor for all reflections: 0.0326
• Residual factor for significantly intense reflections: 0.0309
• Weighted residual factors for significantly intense reflections: 0.0806
• Weighted residual factors for all reflections included in the refinement: 0.082
• Goodness-of-fit parameter for all reflections included in the refinement: 1.146
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes