Information card for entry 2218841

Structure parameters

• Chemical name: Bis(5-chlorosalicylato-κO)bis(1,10-phenanthroline-κ^2^N,N')cadmium(II)
• Formula: C38 H24 Cd Cl2 N4 O6
• Calculated formula: C38 H24 Cd Cl2 N4 O6
• SMILES: [Cd]12([n]3cccc4ccc5ccc[n]1c5c34)([n]1cccc3ccc4ccc[n]2c4c13)(OC(=O)c1c(O)ccc(c1)Cl)OC(=O)c1c(O)ccc(c1)Cl
• Title of publication: Bis(5-chlorosalicylato-κ<i>O</i>)bis(1,10-phenanthroline-κ^2^<i>N</i>,<i>N</i>')cadmium(II)
• Authors of publication: Wen, Decai; Xie, Jing; Jiang, Xiurong
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2008
• Journal volume: 64
• Journal issue: 7
• Pages of publication: m851 - m852
• a: 10.812 ± 0.003 Å
• b: 16.495 ± 0.004 Å
• c: 18.862 ± 0.005 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 3363.9 ± 1.5 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 6
• Space group number: 19
• Hermann-Mauguin space group symbol: P 21 21 21
• Hall space group symbol: P 2ac 2ab
• Residual factor for all reflections: 0.0669
• Residual factor for significantly intense reflections: 0.0449
• Weighted residual factors for significantly intense reflections: 0.0801
• Weighted residual factors for all reflections included in the refinement: 0.0863
• Goodness-of-fit parameter for all reflections included in the refinement: 1.01
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes