Information card for entry 4350438

Structure parameters

• Formula: C98 H112 B2 Cu2 F8 O6 P4
• Calculated formula: C98 H112 B2 Cu2 F8 O6 P4
• Title of publication: Extended calix[4]arene analogues by two P-CuI-P bridges and anion encapsulation.
• Authors of publication: Meng, Xiang-Tai; Li, Qing-Shan; Xu, Feng-Bo; Song, Hai-Bin; Anson, Christopher E.; Zhang, Zheng-Zhi
• Journal of publication: Inorganic chemistry
• Year of publication: 2006
• Journal volume: 45
• Journal issue: 20
• Pages of publication: 7986 - 7987
• a: 25.596 ± 0.005 Å
• b: 19.402 ± 0.004 Å
• c: 22.363 ± 0.005 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 11106 ± 4 ų
• Cell temperature: 294 ± 2 K
• Ambient diffraction temperature: 294 ± 2 K
• Number of distinct elements: 7
• Space group number: 56
• Hermann-Mauguin space group symbol: P c c n
• Hall space group symbol: -P 2ab 2ac
• Residual factor for all reflections: 0.1675
• Residual factor for significantly intense reflections: 0.0758
• Weighted residual factors for significantly intense reflections: 0.2029
• Weighted residual factors for all reflections included in the refinement: 0.2435
• Goodness-of-fit parameter for all reflections included in the refinement: 0.945
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No