Information card for entry 4305870

Structure parameters

• Common name: heptanuclear cluster
• Formula: C116.75 H100.75 Cd5 Cl N40.75 O21.5
• Calculated formula: C116.75 H100.75 Cd5 Cl N40.75 O21.5
• Title of publication: Pentanuclear and Heptanuclear Helicates By Self-Assembly of d10 Metal Ions and a Rigid Aromatic Bis-Bidentate Chelator
• Authors of publication: Ai-Xin Zhu; Jie-Peng Zhang; Yan-Yong Lin; Xiao-Ming Chen
• Journal of publication: Inorganic Chemistry
• Year of publication: 2008
• Journal volume: 47
• Pages of publication: 7389 - 7395
• a: 21.521 ± 0.003 Å
• b: 22.793 ± 0.003 Å
• c: 33.219 ± 0.005 Å
• α: 100.886 ± 0.013°
• β: 102.474 ± 0.013°
• γ: 106.373 ± 0.012°
• Cell volume: 14713 ± 4 ų
• Cell temperature: 150 ± 2 K
• Ambient diffraction temperature: 150 ± 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: 0.1037
• Residual factor for significantly intense reflections: 0.0679
• Weighted residual factors for significantly intense reflections: 0.196
• Weighted residual factors for all reflections included in the refinement: 0.2218
• Goodness-of-fit parameter for all reflections included in the refinement: 1.014
• Diffraction radiation wavelength: 1.54178 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No