Information card for entry 7051704

Structure parameters

• Formula: C52 H128 Cl4 Co2 Cu5 N32 O20
• Calculated formula: C52 H120 Cl4 Co2 Cu5 N32 O20
• Title of publication: Hexacyanidometalate molecular chemistry: di-, tri-, tetra-, penta- (cis/trans) and hepta-nuclear chromium‒copper and cobalt‒copper complexes
• Authors of publication: Hernandez-Molina, Maria; Long, Jérôme; Chamoreau, Lise-Marie; Cantin, Jean-Louis; von Bardeleben, Jürgen; Marvaud, Valérie
• Journal of publication: New Journal of Chemistry
• Year of publication: 2009
• Journal volume: 33
• Journal issue: 6
• Pages of publication: 1301
• a: 27.223 ± 0.006 Å
• b: 12.263 ± 0.002 Å
• c: 28.284 ± 0.004 Å
• α: 90°
• β: 97.02 ± 0.009°
• γ: 90°
• Cell volume: 9371 ± 3 ų
• Cell temperature: 200 ± 2 K
• Ambient diffraction temperature: 200 ± 2 K
• Number of distinct elements: 7
• 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: 0.1136
• Residual factor for significantly intense reflections: 0.0644
• Weighted residual factors for significantly intense reflections: 0.173
• Weighted residual factors for all reflections included in the refinement: 0.2039
• Goodness-of-fit parameter for all reflections included in the refinement: 1.036
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No