Information card for entry 7211218

Structure parameters

• Formula: C118 H103 F24 N31 O33 S8 Zn4
• Calculated formula: C118 H80 F24 N31 O33 S8 Zn4
• Title of publication: Tuning the planarity of [2 ×2] grids
• Authors of publication: Stefankiewicz, Artur R.; Harrowfield, Jack; Madalan, Augustin M.; Lehn, Jean-Marie
• Journal of publication: CrystEngComm
• Year of publication: 2013
• Journal volume: 15
• Journal issue: 44
• Pages of publication: 9128
• a: 29.541 ± 0.006 Å
• b: 18.148 ± 0.004 Å
• c: 27.02 ± 0.005 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 14486 ± 5 ų
• Cell temperature: 173 ± 2 K
• Ambient diffraction temperature: 173 ± 2 K
• Number of distinct elements: 7
• Space group number: 55
• Hermann-Mauguin space group symbol: P b a m
• Hall space group symbol: -P 2 2ab
• Residual factor for all reflections: 0.1333
• Residual factor for significantly intense reflections: 0.0771
• Weighted residual factors for significantly intense reflections: 0.2242
• Weighted residual factors for all reflections included in the refinement: 0.2606
• Goodness-of-fit parameter for all reflections included in the refinement: 1.052
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No