Information card for entry 4115170

Structure parameters

• Formula: C146 H206 Cu10 N8 O33 S12
• Calculated formula: C146 H134 Cu10 N8 O33 S12
• Title of publication: Synthesis, Structure, and Ferromagnetic Behavior of Decacopper(II) Cluster Complex Supported by Hexaanionic p-tert-Butylthiacalix[6]arene
• Authors of publication: Takashi Kajiwara; Noriyoshi Kon; Shuichi Yokozawa; Tasuku Ito; Nobuhiko Iki; Sotaro Miyano
• Journal of publication: Journal of the American Chemical Society
• Year of publication: 2002
• Journal volume: 124
• Pages of publication: 11274 - 11275
• a: 30.043 ± 0.003 Å
• b: 17.1273 ± 0.0018 Å
• c: 35.197 ± 0.004 Å
• α: 90°
• β: 97.659 ± 0.002°
• γ: 90°
• Cell volume: 17949 ± 3 ų
• Cell temperature: 200 ± 2 K
• Ambient diffraction temperature: 200 ± 2 K
• Number of distinct elements: 6
• 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: 0.0958
• Residual factor for significantly intense reflections: 0.0573
• Weighted residual factors for significantly intense reflections: 0.1635
• Weighted residual factors for all reflections included in the refinement: 0.1803
• Goodness-of-fit parameter for all reflections included in the refinement: 0.934
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No