Information card for entry 4126938

Structure parameters

• Formula: C70.676 H59 O10
• Calculated formula: C70.67 H59 O10
• Title of publication: Rim-Differentiated C5-Symmetric Tiara-Pillar[5]arenes.
• Authors of publication: Guo, Minjie; Wang, Xuemei; Zhan, Caihong; Demay-Drouhard, Paul; Li, Wenjiao; Du, Ke; Olson, Mark A.; Zuilhof, Han; Sue, Andrew C.-H.
• Journal of publication: Journal of the American Chemical Society
• Year of publication: 2017
• a: 12.0426 ± 0.0017 Å
• b: 13.8291 ± 0.0017 Å
• c: 19.662 ± 0.002 Å
• α: 78.72 ± 0.008°
• β: 83.606 ± 0.009°
• γ: 78.588 ± 0.007°
• Cell volume: 3138.7 ± 0.7 ų
• Cell temperature: 133 K
• Ambient diffraction temperature: 133 K
• Number of distinct elements: 3
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.1285
• Residual factor for significantly intense reflections: 0.0923
• Weighted residual factors for significantly intense reflections: 0.2958
• Weighted residual factors for all reflections included in the refinement: 0.3221
• Goodness-of-fit parameter for all reflections included in the refinement: 1.1495
• Diffraction radiation wavelength: 0.71075 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No