Information card for entry 2218792

Structure parameters

• Chemical name: Bis(2,5-dihydroxybenzoato-κ<i>O</i>)bis(1,10-phenathroline- κ^2^<i>N</i>,<i>N</i>')cadmium(II) 1.25-hydrate
• Formula: C38 H28.5 Cd N4 O9.25
• Calculated formula: C38 H28.5 Cd N4 O9.25
• Title of publication: Bis(2,5-dihydroxybenzoato-κ<i>O</i>)bis(1,10-phenathroline-κ^2^<i>N</i>,<i>N</i>')cadmium(II) 1.25-hydrate
• Authors of publication: Zhang, Bing-Yu; Nie, Jing-Jing; Xu, Duan-Jun
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2008
• Journal volume: 64
• Journal issue: 7
• Pages of publication: m937
• a: 10.8992 ± 0.0018 Å
• b: 27.3 ± 0.002 Å
• c: 11.4218 ± 0.0012 Å
• α: 90°
• β: 93.7 ± 0.006°
• γ: 90°
• Cell volume: 3391.5 ± 0.7 ų
• Cell temperature: 295 ± 2 K
• Ambient diffraction temperature: 295 ± 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: 0.0739
• Residual factor for significantly intense reflections: 0.0421
• Weighted residual factors for significantly intense reflections: 0.0821
• Weighted residual factors for all reflections included in the refinement: 0.0919
• Goodness-of-fit parameter for all reflections included in the refinement: 1.028
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes