Information card for entry 4074535

Structure parameters

• Formula: C12 H32 Al Cl2 N Si3
• Calculated formula: C12 H32 Al Cl2 N Si3
• SMILES: [Al]1(Cl)(Cl)[N](C[Si](C1([Si](C)(C)C)[Si](C)(C)C)(C)C)(C)C
• Title of publication: [1]Ferrocenophanes, [1]Chromarenophanes, and [1]Vanadarenophanes with Aluminium and Gallium in Bridging Positions
• Authors of publication: Lund, Clinton L.; Schachner, Jörg A.; Quail, J. Wilson; Müller, Jens
• Journal of publication: Organometallics
• Year of publication: 2006
• Journal volume: 25
• Journal issue: 24
• Pages of publication: 5817
• a: 14.5558 ± 0.0002 Å
• b: 10.5318 ± 0.0002 Å
• c: 14.0477 ± 0.0002 Å
• α: 90°
• β: 101.332 ± 0.0012°
• γ: 90°
• Cell volume: 2111.51 ± 0.06 ų
• Cell temperature: 173 ± 2 K
• Ambient diffraction temperature: 173 ± 2 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: 0.0452
• Residual factor for significantly intense reflections: 0.034
• Weighted residual factors for significantly intense reflections: 0.0829
• Weighted residual factors for all reflections included in the refinement: 0.0886
• Goodness-of-fit parameter for all reflections included in the refinement: 1.024
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No