Information card for entry 7038497

Structure parameters

• Formula: C21 H38 Bi Cl2 N Si
• Calculated formula: C21 H38 Bi Cl2 N Si
• SMILES: [Bi](N([Si](C)(C)C)c1c(cc(cc1C(C)(C)C)C(C)(C)C)C(C)(C)C)(Cl)Cl
• Title of publication: Synthesis of mono-, di-, and triaminobismuthanes and observation of C-C coupling of aromatic systems with bismuth(iii) chloride.
• Authors of publication: Hering-Junghans, Christian; Schulz, Axel; Thomas, Max; Villinger, Alexander
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2016
• Journal volume: 45
• Journal issue: 14
• Pages of publication: 6053 - 6059
• a: 12.821 ± 0.0006 Å
• b: 17.8386 ± 0.0008 Å
• c: 11.3085 ± 0.0005 Å
• α: 90°
• β: 109.114 ± 0.003°
• γ: 90°
• Cell volume: 2443.8 ± 0.2 ų
• Cell temperature: 123 ± 2 K
• Ambient diffraction temperature: 123 ± 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: 0.1232
• Residual factor for significantly intense reflections: 0.051
• Weighted residual factors for significantly intense reflections: 0.0803
• Weighted residual factors for all reflections included in the refinement: 0.0998
• Goodness-of-fit parameter for all reflections included in the refinement: 0.98
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No