Information card for entry 7103057

Structure parameters

• Formula: C24 H30.6 N10 O3.3
• Calculated formula: C24 H30 N10 O3.3
• Title of publication: Sulfate ion encapsulation in caged supramolecular structures assembled by second-sphere coordination.
• Authors of publication: Wu, Biao; Liang, Jianjun; Yang, Jin; Jia, Chuandong; Yang, Xiao-Juan; Zhang, Hongrui; Tang, Ning; Janiak, Christoph
• Journal of publication: Chemical communications (Cambridge, England)
• Year of publication: 2008
• Journal issue: 15
• Pages of publication: 1762 - 1764
• a: 25.496 ± 0.002 Å
• b: 9.7959 ± 0.0008 Å
• c: 20.3394 ± 0.0016 Å
• α: 90°
• β: 94.159 ± 0.002°
• γ: 90°
• Cell volume: 5066.5 ± 0.7 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 4
• 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: 0.1117
• Residual factor for significantly intense reflections: 0.0527
• Weighted residual factors for significantly intense reflections: 0.1242
• Weighted residual factors for all reflections included in the refinement: 0.1494
• Goodness-of-fit parameter for all reflections included in the refinement: 1.014
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No