Information card for entry 7122848

Structure parameters

• Formula: C48 H60 F12 N4 O10 P2
• Calculated formula: C48 H60 F12 N4 O10 P2
• Title of publication: Benzobis(imidazolium) salts as templates for the self-assembly of starburst [24]pseudorotaxanes and their corresponding carbene-based classic [22]pseudorotaxanes
• Authors of publication: Foster, Mathew W.; Mehl, Benjamin T.; Treadwell, Ed; Semeniuc, Radu F.; Wheeler, Kraig A.
• Journal of publication: Chemical Communications
• Year of publication: 2019
• a: 22.7748 ± 0.0002 Å
• b: 22.7748 ± 0.0002 Å
• c: 22.9902 ± 0.0003 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 11924.8 ± 0.2 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 6
• Space group number: 122
• Hermann-Mauguin space group symbol: I -4 2 d
• Hall space group symbol: I -4 2bw
• Residual factor for all reflections: 0.0701
• Residual factor for significantly intense reflections: 0.0623
• Weighted residual factors for significantly intense reflections: 0.1801
• Weighted residual factors for all reflections included in the refinement: 0.1866
• Goodness-of-fit parameter for all reflections included in the refinement: 1.061
• Diffraction radiation wavelength: 1.54178 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No