Information card for entry 7051738

Structure parameters

• Formula: C28 H64 Cu4 N4 O20 Zn2
• Calculated formula: C28 H64 Cu4 N4 O20 Zn2
• Title of publication: Isostructural cage complexes of copper with cadmium or zinc for single source deposition of composite materials
• Authors of publication: Shahid, Muhammad; Mazhar, Muhammad; Hamid, Mazhar; Zeller, Matthias; O'Brien, Paul; Malik, Mohammad A.; Raftery, James; Hunter, Allen D.
• Journal of publication: New Journal of Chemistry
• Year of publication: 2009
• Journal volume: 33
• Journal issue: 11
• Pages of publication: 2241
• a: 12.2838 ± 0.0012 Å
• b: 13.3453 ± 0.0013 Å
• c: 13.6289 ± 0.0013 Å
• α: 83.401 ± 0.002°
• β: 84.511 ± 0.002°
• γ: 79.691 ± 0.002°
• Cell volume: 2177.1 ± 0.4 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 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: 0.0706
• Residual factor for significantly intense reflections: 0.0391
• Weighted residual factors for significantly intense reflections: 0.0724
• Weighted residual factors for all reflections included in the refinement: 0.0797
• Goodness-of-fit parameter for all reflections included in the refinement: 0.803
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No