Information card for entry 1571546

Structure parameters

• Formula: C191.88 H203.94 B7.94 Co4 F32.28 N48.11 O17.88
• Calculated formula: C181.881 H151.931 B7.548 Co4 F30.672 N48.107 O1.881
• Title of publication: Photoswitching of Co(ii)-based coordination cages containing azobenzene backbones.
• Authors of publication: Tipping, Max B.; Pruñonosa Lara, Lidón; Solea, Atena B.; von Krbek, Larissa K. S.; Ward, Michael D.
• Journal of publication: Chemical science
• Year of publication: 2024
• Journal volume: 15
• Journal issue: 22
• Pages of publication: 8488 - 8499
• a: 20.35957 ± 0.00013 Å
• b: 21.05549 ± 0.00013 Å
• c: 23.94804 ± 0.00013 Å
• α: 93.3668 ± 0.0005°
• β: 93.7613 ± 0.0005°
• γ: 94.7042 ± 0.0006°
• Cell volume: 10188.2 ± 0.11 ų
• Cell temperature: 100 K
• Ambient diffraction temperature: 100 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: 0.0762
• Residual factor for significantly intense reflections: 0.0638
• Weighted residual factors for significantly intense reflections: 0.1905
• Weighted residual factors for all reflections included in the refinement: 0.1986
• Goodness-of-fit parameter for all reflections included in the refinement: 1.073
• Diffraction radiation wavelength: 0.6889 Å
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No