Information card for entry 2224168

Structure parameters

• Chemical name: Bis(2,2'-bipyridyl)bromidocopper(II) bromide bromoacetic acid hemihydrate
• Formula: C22 H20 Br3 Cu N4 O2.5
• Calculated formula: C22 H20 Br3 Cu N4 O2.5
• Title of publication: Bis(2,2'-bipyridyl)bromidocopper(II) bromide bromoacetic acid hemihydrate
• Authors of publication: Liu, Yaru; Sun, Junshan; Wang, Xinli
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2009
• Journal volume: 65
• Journal issue: 12
• Pages of publication: m1647
• a: 8.58 ± 0.004 Å
• b: 12.125 ± 0.006 Å
• c: 13.212 ± 0.006 Å
• α: 70.295 ± 0.009°
• β: 81.427 ± 0.008°
• γ: 76.669 ± 0.009°
• Cell volume: 1255.3 ± 1 ų
• Cell temperature: 273 ± 2 K
• Ambient diffraction temperature: 273 ± 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: 0.1074
• Residual factor for significantly intense reflections: 0.0673
• Weighted residual factors for significantly intense reflections: 0.1661
• Weighted residual factors for all reflections included in the refinement: 0.1827
• Goodness-of-fit parameter for all reflections included in the refinement: 1.005
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes