Information card for entry 1554598

Structure parameters

• Formula: C531.5 H392.25 F48 N82.25 Ni8 O53.25 S16 Zn6
• Calculated formula: C524.876 H388.726 F28.2 N82.25 Ni8 O33.45 S9.4 Zn6
• Title of publication: Waterproof architectures through subcomponent self-assembly.
• Authors of publication: Percástegui, Edmundo G; Mosquera, Jesús; Ronson, Tanya K.; Plajer, Alex J.; Kieffer, Marion; Nitschke, Jonathan R.
• Journal of publication: Chemical science
• Year of publication: 2019
• Journal volume: 10
• Journal issue: 7
• Pages of publication: 2006 - 2018
• a: 34.21 ± 0.005 Å
• b: 34.21 ± 0.005 Å
• c: 27.215 ± 0.005 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 31850 ± 9 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 8
• Space group number: 85
• Hermann-Mauguin space group symbol: P 4/n :2
• Hall space group symbol: -P 4a
• Residual factor for all reflections: 0.1394
• Residual factor for significantly intense reflections: 0.121
• Weighted residual factors for significantly intense reflections: 0.3372
• Weighted residual factors for all reflections included in the refinement: 0.3532
• Goodness-of-fit parameter for all reflections included in the refinement: 1.053
• Diffraction radiation wavelength: 0.6889 Å
• Diffraction radiation type: Synchrotron
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No