Information card for entry 2239510

Structure parameters

• Chemical name: Tetrakis[μ~3~-2-(piperidin-1-yl)ethanolato]tetrakis[chloridocopper(II)]
• Formula: C28 H56 Cl4 Cu4 N4 O4
• Calculated formula: C28 H56 Cl4 Cu4 N4 O4
• SMILES: [Cu]123(Cl)[N]4(CC[O]52[Cu]26(Cl)[N]7(CC[O]12[Cu]12(Cl)[N]8(CC[O]31[Cu]15(Cl)[N]3(CC[O]621)CCCCC3)CCCCC8)CCCCC7)CCCCC4
• Title of publication: Tetrakis[μ~3~-2-(piperidin-1-yl)ethanolato]tetrakis[chloridocopper(II)]
• Authors of publication: Luo, Mei; Huang, Yong-Hua; Zhang, Jing-Cheng
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2014
• Journal volume: 70
• Journal issue: 5
• Pages of publication: m194
• a: 13.9016 ± 0.0002 Å
• b: 13.9016 ± 0.0002 Å
• c: 38.834 ± 0.0009 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 7504.8 ± 0.2 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 6
• Space group number: 92
• Hermann-Mauguin space group symbol: P 41 21 2
• Hall space group symbol: P 4abw 2nw
• Residual factor for all reflections: 0.0728
• Residual factor for significantly intense reflections: 0.0683
• Weighted residual factors for significantly intense reflections: 0.1786
• Weighted residual factors for all reflections included in the refinement: 0.1819
• Goodness-of-fit parameter for all reflections included in the refinement: 1.165
• Diffraction radiation wavelength: 1.54178 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes