Information card for entry 4348675

Structure parameters

• Formula: C60.5 H79 N2 S Si
• Calculated formula: C60.5 H79 N2 S Si
• Title of publication: The Silicon Version of Phosphine Chalcogenides: Synthesis and Bonding Analysis of Stabilized Heavy Silaaldehydes.
• Authors of publication: Lutters, Dennis; Merk, Anastasia; Schmidtmann, Marc; Müller, Thomas
• Journal of publication: Inorganic chemistry
• Year of publication: 2016
• Journal volume: 55
• Journal issue: 17
• Pages of publication: 9026 - 9032
• a: 15.403 ± 0.0008 Å
• b: 17.2623 ± 0.0009 Å
• c: 20.5674 ± 0.0011 Å
• α: 90°
• β: 107.359 ± 0.0017°
• γ: 90°
• Cell volume: 5219.6 ± 0.5 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 5
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/n 1
• Hall space group symbol: -P 2yn
• Residual factor for all reflections: 0.0824
• Residual factor for significantly intense reflections: 0.0611
• Weighted residual factors for significantly intense reflections: 0.1635
• Weighted residual factors for all reflections included in the refinement: 0.1808
• Goodness-of-fit parameter for all reflections included in the refinement: 1.038
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No