Information card for entry 4125456

Structure parameters

• Formula: C94 H92 F12 N8 O26 Rh4 S4
• Calculated formula: C91 H84 F6 N8 O19 Rh4 S2
• Title of publication: Stacking Interactions Induced Selective Conformation of Discrete Aromatic Arrays and Borromean Rings.
• Authors of publication: Zhang, Long; Lin, Lin; Liu, Dong; Lin, Yue-Jian; Li, Zhen-Hua; Jin, Guo-Xin
• Journal of publication: Journal of the American Chemical Society
• Year of publication: 2017
• Journal volume: 139
• Journal issue: 4
• Pages of publication: 1653 - 1660
• a: 14.412 ± 0.002 Å
• b: 20.181 ± 0.004 Å
• c: 21.21 ± 0.004 Å
• α: 92.724 ± 0.003°
• β: 95.238 ± 0.003°
• γ: 95.152 ± 0.003°
• Cell volume: 6108.7 ± 1.9 ų
• Cell temperature: 173 ± 2 K
• Ambient diffraction temperature: 173 ± 2 K
• Number of distinct elements: 7
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.1486
• Residual factor for significantly intense reflections: 0.0902
• Weighted residual factors for significantly intense reflections: 0.2383
• Weighted residual factors for all reflections included in the refinement: 0.2692
• Goodness-of-fit parameter for all reflections included in the refinement: 0.929
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No