Information card for entry 4332200

Structure parameters

• Formula: C26 H56 Cl4 Co2 Cu4 N4 O10
• Calculated formula: C26 H56 Cl4 Co2 Cu4 N4 O10
• SMILES: C1(=CC(=[O][Co]2345(O1)[O]16CC[N](C)(C)[Cu]71([OH]1[Co]89%10(OC(=CC(=[O]8)C)C)([O]8%11CC[N](C)(C)[Cu]%128([OH]4[Cu]45%11%12([N](CC[O]294)(C)C)Cl)Cl)[O]23CC[N](C)(C)[Cu]671%102Cl)Cl)C)C
• Title of publication: Synthesis of Isostructural Cage Complexes of Copper with Cobalt and Nickel for Deposition of Mixed Ceramic Oxide Materials
• Authors of publication: Hamid, Mazhar; Tahir, Asif A.; Mazhar, Muhammad; Zeller, Matthias; Molloy, Kieran C.; Hunter, Allen D.
• Journal of publication: Inorganic Chemistry
• Year of publication: 2006
• Journal volume: 45
• Journal issue: 26
• Pages of publication: 10457 - 10466
• a: 10.5625 ± 0.0008 Å
• b: 10.6274 ± 0.0008 Å
• c: 19.7117 ± 0.0014 Å
• α: 90°
• β: 98.095 ± 0.001°
• γ: 90°
• Cell volume: 2190.6 ± 0.3 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 7
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/n 1
• Hall space group symbol: -P 2yn
• Residual factor for all reflections: 0.0281
• Residual factor for significantly intense reflections: 0.0255
• Weighted residual factors for significantly intense reflections: 0.0678
• Weighted residual factors for all reflections included in the refinement: 0.0694
• Goodness-of-fit parameter for all reflections included in the refinement: 1.052
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No