Information card for entry 2226604

Structure parameters

• Chemical name: Bis(μ-2,4-dihydroxybenzoato-κ^2^<i>O</i>:<i>O</i>')bis[aqua(2,4- dihydroxybenzoato-κ<i>O</i>)(1,10-phenanthroline- κ^2^<i>N</i>,<i>N</i>')cadmium(II)]
• Formula: C52 H40 Cd2 N4 O18
• Calculated formula: C52 H40 Cd2 N4 O18
• Title of publication: Bis(μ-2,4-dihydroxybenzoato-κ^2^<i>O</i>:<i>O</i>')bis[aqua(2,4-dihydroxybenzoato-κ<i>O</i>)(1,10-phenanthroline-κ^2^<i>N</i>,<i>N</i>')cadmium(II)]
• Authors of publication: Nie, Jing-Jing; Pan, Tian-Tian; Su, Jian-Rong; Xu, Duan-Jun
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2010
• Journal volume: 66
• Journal issue: 7
• Pages of publication: m760 - m761
• a: 14.899 ± 0.004 Å
• b: 6.874 ± 0.002 Å
• c: 23.4 ± 0.006 Å
• α: 90°
• β: 103.378 ± 0.002°
• γ: 90°
• Cell volume: 2331.5 ± 1.1 ų
• Cell temperature: 296 ± 2 K
• Ambient diffraction temperature: 296 ± 2 K
• Number of distinct elements: 5
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/n 1
• Hall space group symbol: -P 2yn
• Residual factor for all reflections: 0.0335
• Residual factor for significantly intense reflections: 0.0278
• Weighted residual factors for significantly intense reflections: 0.0653
• Weighted residual factors for all reflections included in the refinement: 0.0671
• Goodness-of-fit parameter for all reflections included in the refinement: 1.11
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: Yes