Information card for entry 7202153

Structure parameters

• Formula: C32 H44 Eu N2 Na2 O28.5 S4
• Calculated formula: C32 H23 Eu N2 Na2 O28.5 S4
• Title of publication: Guest inducing p-sulfonatocalix[4]arene into three-dimensional capsule architecture and a mixed A‒B double layer framework
• Authors of publication: Zheng, Guoli; Zhang, Feng; Li, Yinyan; Zhang, Hongjie
• Journal of publication: CrystEngComm
• Year of publication: 2008
• Journal volume: 10
• Journal issue: 11
• Pages of publication: 1560
• a: 31.695 ± 0.003 Å
• b: 17.9061 ± 0.0012 Å
• c: 22.221 ± 0.002 Å
• α: 90°
• β: 133.979 ± 0.002°
• γ: 90°
• Cell volume: 9074.9 ± 1.4 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 7
• 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: 0.1084
• Residual factor for significantly intense reflections: 0.0597
• Weighted residual factors for significantly intense reflections: 0.1377
• Weighted residual factors for all reflections included in the refinement: 0.1622
• Goodness-of-fit parameter for all reflections included in the refinement: 1.01
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No