Information card for entry 2209899

Structure parameters

• Chemical name: Bis[aquachlorobis(1,10-phenanthroline)cadmium(II)] benzene-1,4-dioxydiacetate sesquihydrate
• Formula: C58 H49 Cd2 Cl2 N8 O9.5
• Calculated formula: C58 H47 Cd2 Cl2 N8 O9.5
• Title of publication: Bis[aquachlorobis(1,10-phenanthroline)cadmium(II)] benzene-1,4-dioxydiacetate sesquihydrate
• Authors of publication: Yong-Cai Qiu; Chen-Long Chen; Rong-Hua Zeng; Yue-Peng Cai; Hong Deng
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2006
• Journal volume: 62
• Journal issue: 8
• Pages of publication: m1979 - m1981
• a: 10.1053 ± 0.0002 Å
• b: 12.1099 ± 0.0002 Å
• c: 12.9095 ± 0.0003 Å
• α: 62.297 ± 0.001°
• β: 84.131 ± 0.001°
• γ: 72.597 ± 0.001°
• Cell volume: 1333.41 ± 0.05 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 6
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0285
• Residual factor for significantly intense reflections: 0.025
• Weighted residual factors for significantly intense reflections: 0.0646
• Weighted residual factors for all reflections included in the refinement: 0.0664
• Goodness-of-fit parameter for all reflections included in the refinement: 1.062
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes