Information card for entry 2207112

Structure parameters

• Chemical name: (2,2'-Bipyridyl-κ^2^N,N')(chloranilato-κ^2^O,O')copper(II)
• Formula: C16 H8 Cl2 Cu N2 O4
• Calculated formula: C16 H8 Cl2 Cu N2 O4
• SMILES: [Cu]12(OC3=C(Cl)C(=O)C(=O)C(=C3O1)Cl)[n]1ccccc1c1cccc[n]21
• Title of publication: (2,2'-Bipyridyl-κ^2^<i>N</i>,<i>N</i>')(chloranilato-κ^2^<i>O</i>,<i>O</i>')copper(II)
• Authors of publication: Reinoso, Santiago; Vitoria, Pablo; San Felices, Leire; Lezama, Luis; Gutiérrez-Zorrilla, Juan M.
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2005
• Journal volume: 61
• Journal issue: 10
• Pages of publication: m1925 - m1927
• a: 24.987 ± 0.003 Å
• b: 7.438 ± 0.001 Å
• c: 17.215 ± 0.002 Å
• α: 90°
• β: 104.57 ± 0.01°
• γ: 90°
• Cell volume: 3096.6 ± 0.7 ų
• Cell temperature: 295 ± 2 K
• Number of distinct elements: 6
• Space group number: 15
• Hermann-Mauguin space group symbol: C 1 2/c 1
• Hall space group symbol: -C 2yc
• Residual factor for all reflections: 0.111
• Residual factor for significantly intense reflections: 0.035
• Weighted residual factors for significantly intense reflections: 0.055
• Weighted residual factors for all reflections included in the refinement: 0.065
• Goodness-of-fit parameter for all reflections included in the refinement: 0.74
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes