Information card for entry 4038437

Structure parameters

• Formula: C23 H63 N3 P2 Si8
• Calculated formula: C23 H63 N3 P2 Si8
• Title of publication: Heterocyclopentanediyls vs Heterocyclopentadienes: A Question of Silyl Group Migration.
• Authors of publication: Beer, Henrik; Bresien, Jonas; Michalik, Dirk; Rölke, Anne-Kristin; Schulz, Axel; Villinger, Alexander; Wustrack, Ronald
• Journal of publication: The Journal of organic chemistry
• Year of publication: 2020
• a: 15.445 ± 0.003 Å
• b: 16.11 ± 0.004 Å
• c: 16.603 ± 0.004 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 4131.1 ± 1.6 ų
• Cell temperature: 123 ± 2 K
• Ambient diffraction temperature: 123 ± 2 K
• Number of distinct elements: 5
• Space group number: 19
• Hermann-Mauguin space group symbol: P 21 21 21
• Hall space group symbol: P 2ac 2ab
• Residual factor for all reflections: 0.089
• Residual factor for significantly intense reflections: 0.0496
• Weighted residual factors for significantly intense reflections: 0.1092
• Weighted residual factors for all reflections included in the refinement: 0.1167
• Goodness-of-fit parameter for all reflections included in the refinement: 0.832
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No