Information card for entry 7104299

Structure parameters

• Common name: H5 Sm (C24H8O24S8) (C12H8N2)4 (H2O)7.90
• Formula: C72 H60.8 N8 O31.9 S8 Sm
• Calculated formula: C72 H40 N8 O31.893 S8 Sm
• Title of publication: Macroscopic single-crystal tubes assembled with porous supramolecular architecture of water-soluble calixarene and phenanthroline.
• Authors of publication: Liao, Wuping; Li, Yanling; Wang, Xiaofei; Bi, Yanfeng; Su, Zhongmin; Zhang, Hongjie
• Journal of publication: Chemical communications (Cambridge, England)
• Year of publication: 2009
• Journal volume: 34
• Journal issue: 14
• Pages of publication: 1861 - 1863
• a: 14.3503 ± 0.0018 Å
• b: 17.955 ± 0.002 Å
• c: 19.182 ± 0.002 Å
• α: 112.135 ± 0.002°
• β: 92.414 ± 0.002°
• γ: 97.789 ± 0.002°
• Cell volume: 4512.7 ± 1 ų
• Cell temperature: 120 ± 2 K
• Ambient diffraction temperature: 120 ± 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: 0.1657
• Residual factor for significantly intense reflections: 0.1058
• Weighted residual factors for significantly intense reflections: 0.2649
• Weighted residual factors for all reflections included in the refinement: 0.2957
• Goodness-of-fit parameter for all reflections included in the refinement: 1.06
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No