Information card for entry 4124880

Structure parameters

• Formula: C190 H177 F24 N27 O36 S8 Zn4
• Calculated formula: C189 H177 F20.9998 N27 O32.9999 S6.99995 Zn4
• Title of publication: Subcomponent Flexibility Enables Conversion between D4-Symmetric Cd(II)8L8 and T-Symmetric Cd(II)4L4 Assemblies.
• Authors of publication: Mosquera, Jesús; Ronson, Tanya K.; Nitschke, Jonathan R.
• Journal of publication: Journal of the American Chemical Society
• Year of publication: 2016
• Journal volume: 138
• Journal issue: 6
• Pages of publication: 1812 - 1815
• a: 27.046 ± 0.0005 Å
• b: 27.046 ± 0.0005 Å
• c: 37.5383 ± 0.0009 Å
• α: 90°
• β: 90°
• γ: 120°
• Cell volume: 23780 ± 0.8 ų
• Cell temperature: 180 ± 2 K
• Ambient diffraction temperature: 180 ± 2 K
• Number of distinct elements: 7
• Space group number: 173
• Hermann-Mauguin space group symbol: P 63
• Hall space group symbol: P 6c
• Residual factor for all reflections: 0.085
• Residual factor for significantly intense reflections: 0.0617
• Weighted residual factors for significantly intense reflections: 0.1598
• Weighted residual factors for all reflections included in the refinement: 0.1711
• Goodness-of-fit parameter for all reflections included in the refinement: 1.039
• Diffraction radiation wavelength: 1.54178 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No