Information card for entry 2223089

Structure parameters

• Chemical name: Tetraaquabis[2-(2,4-dichlorophenoxy)acetato]nickel(II)
• Formula: C16 H18 Cl4 Ni O10
• Calculated formula: C16 H18 Cl4 Ni O10
• SMILES: c1cc(c(cc1Cl)Cl)OCC(=O)O[Ni]([OH2])([OH2])([OH2])([OH2])OC(=O)COc1c(cc(cc1)Cl)Cl
• Title of publication: Tetraaquabis[2-(2,4-dichlorophenoxy)acetato]nickel(II)
• Authors of publication: Chen, Wu; Yuan, Ji-Wen; Lei, Lei; Zeng, Qing-Fu
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2009
• Journal volume: 65
• Journal issue: 9
• Pages of publication: m1148
• a: 16.86 ± 0.003 Å
• b: 8.137 ± 0.0016 Å
• c: 8.301 ± 0.0017 Å
• α: 90°
• β: 95.87 ± 0.03°
• γ: 90°
• Cell volume: 1132.8 ± 0.4 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 5
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/c 1
• Hall space group symbol: -P 2ybc
• Residual factor for all reflections: 0.091
• Residual factor for significantly intense reflections: 0.0714
• Weighted residual factors for significantly intense reflections: 0.1721
• Weighted residual factors for all reflections included in the refinement: 0.2135
• Goodness-of-fit parameter for all reflections included in the refinement: 1.143
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes