Information card for entry 4064076

Structure parameters

• Formula: C18 H52 Si9
• Calculated formula: C18 H52 Si9
• SMILES: [Si]1([Si]2([Si](C)(C)C[Si]([Si]([Si](C)(C)C1)([Si]2(C)C)[Si](C)(C)C)(C)C)[Si](C)(C)C)(C)C
• Title of publication: Rearrangement/Fragmentation Reactions of Oligosilanes with Aluminum Chloride.
• Authors of publication: Wagner, Harald; Baumgartner, Judith; Marschner, Christoph; Poelt, Peter
• Journal of publication: Organometallics
• Year of publication: 2011
• Journal volume: 30
• Journal issue: 15
• Pages of publication: 3939 - 3954
• a: 9.3855 ± 0.0019 Å
• b: 11.547 ± 0.002 Å
• c: 16.262 ± 0.003 Å
• α: 71.75 ± 0.03°
• β: 80.8 ± 0.03°
• γ: 73.88 ± 0.03°
• Cell volume: 1602.8 ± 0.6 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 3
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0605
• Residual factor for significantly intense reflections: 0.0536
• Weighted residual factors for significantly intense reflections: 0.1306
• Weighted residual factors for all reflections included in the refinement: 0.1358
• Goodness-of-fit parameter for all reflections included in the refinement: 1.097
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No