Information card for entry 2020788

Structure parameters

• Chemical name: Bis{μ~3~-3-[(4-methoxy-2-oxidobenzylidene)amino]propanolato}bis{μ~2~-3-[(4-methoxy-2-oxidobenzylidene)amino]propanolato}tetracopper(II)
• Formula: C44 H52 Cu4 N4 O12
• Calculated formula: C44 H52 Cu4 N4 O12
• Title of publication: A new stepped tetranuclear copper(II) complex: synthesis, crystal structure and photoluminescence properties
• Authors of publication: Gungor, Elif
• Journal of publication: Acta Crystallographica Section C
• Year of publication: 2017
• Journal volume: 73
• Journal issue: 5
• Pages of publication: 393 - 398
• a: 16.2592 ± 0.0003 Å
• b: 14.2078 ± 0.0003 Å
• c: 9.256 ± 0.0002 Å
• α: 90°
• β: 92.527 ± 0.001°
• γ: 90°
• Cell volume: 2136.13 ± 0.08 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 99.95 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: 0.0864
• Residual factor for significantly intense reflections: 0.051
• Weighted residual factors for significantly intense reflections: 0.112
• Weighted residual factors for all reflections included in the refinement: 0.1225
• Goodness-of-fit parameter for all reflections included in the refinement: 1.206
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: Yes