Information card for entry 1569756

Structure parameters

• Chemical name: μ-1,6-Dioxo-1,6-diphenylhexane-3,4-diolato-bis[(2,2'-bipyridine)chloridocopper(II)] dihydrate
• Formula: C38 H32 Cl2 Cu2 N4 O6
• Calculated formula: C38 H32 Cl2 Cu2 N4 O6
• Title of publication: μ-1,6-Dioxo-1,6-diphenylhexane-3,4-diolato-bis[(2,2′-bipyridine)chloridocopper(II)] dihydrate
• Authors of publication: Nye, Luke; Telfer, Shane G.; Turnbull, Mark M.
• Journal of publication: IUCrData
• Year of publication: 2023
• Journal volume: 8
• Journal issue: 8
• a: 8.7211 ± 0.0002 Å
• b: 10.4194 ± 0.0002 Å
• c: 10.5243 ± 0.0007 Å
• α: 106.426 ± 0.007°
• β: 109.09 ± 0.008°
• γ: 90.373 ± 0.006°
• Cell volume: 861.67 ± 0.09 ų
• Cell temperature: 123 ± 2 K
• Ambient diffraction temperature: 123 ± 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: 0.0615
• Residual factor for significantly intense reflections: 0.0474
• Weighted residual factors for significantly intense reflections: 0.112
• Weighted residual factors for all reflections included in the refinement: 0.121
• Goodness-of-fit parameter for all reflections included in the refinement: 1.129
• Diffraction radiation wavelength: 1.54178 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No