Information card for entry 2207405

Structure parameters

• Chemical name: catena-Poly[[diaqua(1,10-phenanthroline-κ^2^N,N')cadmium(II)]-μ- fumarato-κ^2^O:O']
• Formula: C16 H14 Cd N2 O6
• Calculated formula: C16 H14 Cd N2 O6
• SMILES: [Cd]1([OH2])([OH2])([n]2cccc3ccc4ccc[n]1c4c23)OC(=O)/C=C/C(=O)O[Cd]2(OC(=O)/C=C/C(=O)[O-])([OH2])([OH2])[n]3cccc4ccc5ccc[n]2c5c34
• Title of publication: <i>catena</i>-Poly[[diaqua(1,10-phenanthroline-κ^2^<i>N</i>,<i>N</i>')cadmium(II)]-μ-fumarato-κ^2^<i>O</i>:<i>O</i>']
• Authors of publication: Sun, Ya-Guang; Gao, En-Jun; Liu, Xia; Wang, Cheng-Shen
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2005
• Journal volume: 61
• Journal issue: 11
• Pages of publication: m2190 - m2191
• a: 11.76 ± 0.009 Å
• b: 13.06 ± 0.01 Å
• c: 11.243 ± 0.009 Å
• α: 90°
• β: 114.92 ± 0.01°
• γ: 90°
• Cell volume: 1566 ± 2 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 5
• Space group number: 15
• Hermann-Mauguin space group symbol: C 1 2/c 1
• Hall space group symbol: -C 2yc
• Residual factor for all reflections: 0.025
• Residual factor for significantly intense reflections: 0.02
• Weighted residual factors for significantly intense reflections: 0.047
• Weighted residual factors for all reflections included in the refinement: 0.048
• Goodness-of-fit parameter for all reflections included in the refinement: 1.04
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No