Information card for entry 7135153

Structure parameters

• Formula: C43 H40 F10 N4 O9 Zn
• Calculated formula: C43 H40 F10 N4 O9 Zn
• Title of publication: Mechanically Interlocked Porphyrinoids: Self-Assembly of Metal-Stabilised Catenaphyrins
• Authors of publication: Sarwa, Aleksandra; Matviyishyn, Maksym; Perdek, Jędrzej P.; Trzaskowski, Bartosz; Kulesza, Dagmara; Zych, Eugeniusz; Szyszko, Bartosz
• Journal of publication: Chemical Communications
• Year of publication: 2025
• a: 10.981 ± 0.003 Å
• b: 14.833 ± 0.004 Å
• c: 13.238 ± 0.003 Å
• α: 90°
• β: 90.05 ± 0.02°
• γ: 90°
• Cell volume: 2156.2 ± 1 ų
• Cell temperature: 100 ± 0.1 K
• Ambient diffraction temperature: 100 ± 0.1 K
• Number of distinct elements: 6
• Space group number: 4
• Hermann-Mauguin space group symbol: P 1 21 1
• Hall space group symbol: P 2yb
• Residual factor for all reflections: 0.0224
• Residual factor for significantly intense reflections: 0.0221
• Weighted residual factors for significantly intense reflections: 0.0581
• Weighted residual factors for all reflections included in the refinement: 0.0583
• Goodness-of-fit parameter for all reflections included in the refinement: 1.038
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 1.54184 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No