Information card for entry 7045774

Structure parameters

• Formula: C55 H46 N4 O10
• Calculated formula: C55 H46 N4 O10
• Title of publication: Engineering a pillar[5]arene-based supramolecular organic framework by a co-crystallization method.
• Authors of publication: Wang, Guo; Hu, Wei-Bo; Zhao, Xiao-Li; Liu, Yahu A.; Li, Jiu-Sheng; Jiang, Biao; Wen, Ke
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2018
• Journal volume: 47
• Journal issue: 15
• Pages of publication: 5144 - 5148
• a: 15.3667 ± 0.0009 Å
• b: 15.6328 ± 0.0009 Å
• c: 15.7002 ± 0.0009 Å
• α: 67.7639 ± 0.0017°
• β: 67.4261 ± 0.0019°
• γ: 73.0486 ± 0.0018°
• Cell volume: 3176.1 ± 0.3 ų
• Cell temperature: 296 ± 2 K
• Ambient diffraction temperature: 296.15 K
• Number of distinct elements: 4
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.1016
• Residual factor for significantly intense reflections: 0.0571
• Weighted residual factors for significantly intense reflections: 0.1464
• Weighted residual factors for all reflections included in the refinement: 0.1686
• Goodness-of-fit parameter for all reflections included in the refinement: 1.016
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No