Information card for entry 7023669

Structure parameters

• Formula: C31 H24 Cl2 Cu N5 O6 S0
• Calculated formula: C31 H24 Cl2 Cu N5 O6
• Title of publication: Stacking of metal chelating rings with π-systems in mononuclear complexes of copper(ii) with 3,6-dichloro-2,5-dihydroxy-1,4-benzoquinone (chloranilic acid) and 2,2'-bipyridine ligands.
• Authors of publication: Molčanov, Krešimir; Jurić, Marijana; Kojić-Prodić, Biserka
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2013
• Journal volume: 42
• Journal issue: 44
• Pages of publication: 15756 - 15765
• a: 10.2366 ± 0.0009 Å
• b: 13.1074 ± 0.0009 Å
• c: 13.4361 ± 0.0012 Å
• α: 63.309 ± 0.008°
• β: 68.186 ± 0.008°
• γ: 81.456 ± 0.007°
• Cell volume: 1495 ± 0.3 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 significantly intense reflections: 0.102
• Weighted residual factors for all reflections included in the refinement: 0.2627
• Goodness-of-fit parameter for all reflections included in the refinement: 0.886
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 1.54184 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No