Information card for entry 2020936

Structure parameters

• Chemical name: Poly[μ-adipato-κ^2^<i>O</i>^1^:<i>O</i>^4^-μ-adipato-κ^4^<i>O</i>^1^,<i>O</i>^1'^:<i>O</i>^4^,<i>O</i>^4'^-diaquabis[μ-1,4-bis(pyridin-4-yl)-1,3-butadiene-κ^2^<i>N</i>:<i>N</i>']dicadmium]
• Formula: C20 H22 Cd N2 O5
• Calculated formula: C20 H22 Cd N2 O5
• Title of publication: A three-dimensional supramolecular framework based on the interlinkage of an interpenetrating diamondoid coordination network
• Authors of publication: Hou, Yi-Xuan; Liu, Dong
• Journal of publication: Acta Crystallographica Section C
• Year of publication: 2017
• Journal volume: 73
• Journal issue: 11
• Pages of publication: 869 - 873
• a: 8.7119 ± 0.0017 Å
• b: 10.318 ± 0.002 Å
• c: 10.961 ± 0.002 Å
• α: 83.47 ± 0.03°
• β: 82.91 ± 0.03°
• γ: 84.71 ± 0.03°
• Cell volume: 968.3 ± 0.3 ų
• Cell temperature: 223 ± 2 K
• Ambient diffraction temperature: 223 ± 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: 0.0301
• Residual factor for significantly intense reflections: 0.0284
• Weighted residual factors for significantly intense reflections: 0.075
• Weighted residual factors for all reflections included in the refinement: 0.0757
• Goodness-of-fit parameter for all reflections included in the refinement: 1.16
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes