Information card for entry 7716494

Structure parameters

• Formula: C40 H49 F9 O9 S3 Si3
• Calculated formula: C40 H49 F9 O9 S3 Si3
• Title of publication: Host-guest chemistry of tridentate Lewis acids based on tribenzotriquinacene.
• Authors of publication: Franke, Maurice; Ens, Tobin; Mix, Andreas; Neumann, Beate; Stammler, Hans-Georg; Mitzel, Norbert W.
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2024
• Journal volume: 53
• Journal issue: 28
• Pages of publication: 11970 - 11980
• a: 17.6372 ± 0.0006 Å
• b: 16.1597 ± 0.0005 Å
• c: 34.9455 ± 0.0011 Å
• α: 90°
• β: 91.786 ± 0.003°
• γ: 90°
• Cell volume: 9955 ± 0.6 ų
• Cell temperature: 100 ± 0.1 K
• Ambient diffraction temperature: 100 ± 0.1 K
• Number of distinct elements: 6
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/c 1
• Hall space group symbol: -P 2ybc
• Residual factor for all reflections: 0.1289
• Residual factor for significantly intense reflections: 0.0988
• Weighted residual factors for significantly intense reflections: 0.2465
• Weighted residual factors for all reflections included in the refinement: 0.2682
• Goodness-of-fit parameter for all reflections included in the refinement: 1.037
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 1.54184 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No