Information card for entry 1542457

Structure parameters

• Chemical name: Bis(acetato-κ<i>O</i>)bis{2-[4-(pyridin-2-yl)phenyl]-1<i>H</i>-imidazo[4,5-<i>f</i>][1,10]phenanthroline-κ^2^<i>N</i>,<i>N</i>'}cadmium(II)
• Formula: C52 H36 Cd N10 O4
• Calculated formula: C52 H36 Cd N10 O4
• SMILES: [Cd]12(OC(=O)C)(OC(=O)C)([n]3cccc4c3c3[n]1cccc3c1[nH]c(nc41)c1ccc(cc1)c1ncccc1)[n]1cccc3c1c1[n]2cccc1c1[nH]c(nc31)c1ccc(cc1)c1ncccc1
• Title of publication: Bis(acetato-κ<i>O</i>)bis{2-[4-(pyridin-2-yl)phenyl]-1<i>H</i>-imidazo[4,5-<i>f</i>][1,10]phenanthroline-κ^2^<i>N</i>,<i>N</i>'}cadmium(II)
• Authors of publication: Guo, Lei-Qun; Jiang, Yin-Hua
• Journal of publication: IUCrData
• Year of publication: 2016
• Journal volume: 1
• Journal issue: 1
• Pages of publication: x160063
• a: 9.2984 ± 0.0012 Å
• b: 9.3261 ± 0.0014 Å
• c: 12.5747 ± 0.0016 Å
• α: 107.16 ± 0.002°
• β: 103.719 ± 0.003°
• γ: 96.55 ± 0.002°
• Cell volume: 992.1 ± 0.2 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 5
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0555
• Residual factor for significantly intense reflections: 0.0494
• Weighted residual factors for significantly intense reflections: 0.117
• Weighted residual factors for all reflections included in the refinement: 0.1224
• Goodness-of-fit parameter for all reflections included in the refinement: 1.067
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes