Information card for entry 2016983

Structure parameters

• Chemical name: Poly[[[μ-1,1'-(butane-1,4-diyl)diimidazole-κ^2^<i>N</i>:<i>N</i>']\ (μ-cyclohexane-1,4-dicarboxylato-\ κ^4^<i>O</i>^1^,<i>O</i>^1'^:<i>O</i>^4^,<i>O</i>^4'^)cadmium(II)] hemihydrate]
• Formula: C18 H25 Cd N4 O4.5
• Calculated formula: C18 H25 Cd N4 O4.5
• Title of publication: Poly[[[μ-1,1'-(butane-1,4-diyl)diimidazole-κ^2^<i>N</i>:<i>N</i>'](μ-cyclohexane-1,4-dicarboxylato-κ^4^<i>O</i>^1^,<i>O</i>^1'^:<i>O</i>^4^,<i>O</i>^4'^)cadmium(II)] hemihydrate]: a parallel interpenetrating two-dimensional (4,4) network
• Authors of publication: Zhou, Shi; Liu, Bo; Li, Chuan-Bi
• Journal of publication: Acta Crystallographica Section C
• Year of publication: 2009
• Journal volume: 65
• Journal issue: 2
• Pages of publication: m107 - m109
• a: 9.468 ± 0.004 Å
• b: 12.339 ± 0.005 Å
• c: 17.817 ± 0.008 Å
• α: 90°
• β: 97.864 ± 0.006°
• γ: 90°
• Cell volume: 2061.9 ± 1.5 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 5
• 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: 0.0422
• Residual factor for significantly intense reflections: 0.0343
• Weighted residual factors for significantly intense reflections: 0.0772
• Weighted residual factors for all reflections included in the refinement: 0.0808
• Goodness-of-fit parameter for all reflections included in the refinement: 1.037
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes