Information card for entry 2218366

Structure parameters

• Chemical name: Aqua{2-[(3,5-dichloro-2-oxidobenzylidene)amino]-3-(4-hydroxyphenyl)propionato- κ^3^<i>O</i>^1^,<i>N</i>,<i>O</i>^2^}copper(II) sesquihydrate
• Formula: C32 H32 Cl4 Cu2 N2 O13
• Calculated formula: C16 H16 Cl2 Cu N O6.5
• Title of publication: Aqua{2-[(3,5-dichloro-2-oxidobenzylidene)amino]-3-(4-hydroxyphenyl)propionato-κ^3^<i>O</i>^1^,<i>N</i>,<i>O</i>^2^}copper(II) sesquihydrate
• Authors of publication: Liu, Zheng; Wang, Yong Liao; Wang, Li
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2008
• Journal volume: 64
• Journal issue: 6
• Pages of publication: m756
• a: 10.006 ± 0.002 Å
• b: 13.899 ± 0.002 Å
• c: 14.565 ± 0.002 Å
• α: 70.469 ± 0.002°
• β: 87.427 ± 0.003°
• γ: 73.121 ± 0.003°
• Cell volume: 1823.8 ± 0.5 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: 0.0993
• Residual factor for significantly intense reflections: 0.0471
• Weighted residual factors for significantly intense reflections: 0.1108
• Weighted residual factors for all reflections included in the refinement: 0.1427
• Goodness-of-fit parameter for all reflections included in the refinement: 1.021
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: Yes