Information card for entry 2221646

Structure parameters

• Chemical name: Bis(2,2'-bipyridyl)-1κ^2^<i>N</i>,<i>N</i>';3κ^2^<i>N</i>,<i>N</i>'- bis(4-bromo-2-formylphenolato)- 1κ^2^<i>O</i>,<i>O</i>';3κ^2^<i>O</i>,<i>O</i>'- bis[μ-2-(5-bromo-2-oxidobenzylideneamino)ethanesulfonato]- 1:2κ^3^<i>O</i>:<i>N</i>,<i>O</i>^2^;2:3κ^3^<i>N</i>,<i>O</i>^2^:<i>O</i>- tricopper(II) monohydrate
• Formula: C52 H42 Br4 Cu3 N6 O13 S2
• Calculated formula: C52 H42 Br4 Cu3 N6 O13 S2
• Title of publication: Bis(2,2'-bipyridyl)-1κ^2^<i>N</i>,<i>N</i>';3κ^2^<i>N</i>,<i>N</i>'-bis(4-bromo-2-formylphenolato)-1κ^2^<i>O</i>,<i>O</i>';3κ^2^<i>O</i>,<i>O</i>'-bis[μ-2-(5-bromo-2-oxidobenzylideneamino)ethanesulfonato]-1:2κ^3^<i>O</i>:<i>N</i>,<i>O</i>^2^;2:3κ^3^<i>N</i>,<i>O</i>^2^:<i>O</i>-tricopper(II) monohydrate
• Authors of publication: Zhang, Ling
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2009
• Journal volume: 65
• Journal issue: 5
• Pages of publication: m552
• a: 10.031 ± 0.002 Å
• b: 11.48 ± 0.002 Å
• c: 12.913 ± 0.003 Å
• α: 73.13 ± 0.03°
• β: 78.58 ± 0.03°
• γ: 75.24 ± 0.03°
• Cell volume: 1363.6 ± 0.6 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 7
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.1763
• Residual factor for significantly intense reflections: 0.0473
• Weighted residual factors for significantly intense reflections: 0.0806
• Weighted residual factors for all reflections included in the refinement: 0.0993
• Goodness-of-fit parameter for all reflections included in the refinement: 0.758
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes