Information card for entry 4123398

Structure parameters

• Formula: C190 H136 Cd4 Co2 F48 N30 O33 S16
• Calculated formula: C185.475 H132 Cd4 Co2 F34.05 N27.55 O24.1 S11.475
• Title of publication: Cooperative loading and release behavior of a metal-organic receptor.
• Authors of publication: Gan, Quan; Ronson, Tanya K.; Vosburg, David A.; Thoburn, John D.; Nitschke, Jonathan R.
• Journal of publication: Journal of the American Chemical Society
• Year of publication: 2015
• Journal volume: 137
• Journal issue: 5
• Pages of publication: 1770 - 1773
• a: 24.435 ± 0.002 Å
• b: 28.08 ± 0.002 Å
• c: 37.608 ± 0.003 Å
• α: 90.018 ± 0.004°
• β: 99.198 ± 0.004°
• γ: 106.888 ± 0.003°
• Cell volume: 24344 ± 3 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 8
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.1683
• Residual factor for significantly intense reflections: 0.1325
• Weighted residual factors for significantly intense reflections: 0.3459
• Weighted residual factors for all reflections included in the refinement: 0.3724
• Goodness-of-fit parameter for all reflections included in the refinement: 1.213
• Diffraction radiation wavelength: 0.6889 Å
• Diffraction radiation type: synchrotron
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No