Information card for entry 7038496

Structure parameters

• Formula: C38 H54 Bi2 N4 Si2
• Calculated formula: C38 H54 Bi2 N4 Si2
• SMILES: [Bi]1(N([Bi](N1c1c(cccc1C)C)N([Si](C)(C)C)c1c(cccc1C)C)c1c(cccc1C)C)N([Si](C)(C)C)c1c(cccc1C)C
• 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: 15.4153 ± 0.0006 Å
• b: 11.6452 ± 0.0005 Å
• c: 22.13 ± 0.001 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 3972.7 ± 0.3 ų
• Cell temperature: 173 ± 2 K
• Ambient diffraction temperature: 173 ± 2 K
• Number of distinct elements: 5
• Space group number: 33
• Hermann-Mauguin space group symbol: P n a 21
• Hall space group symbol: P 2c -2n
• Residual factor for all reflections: 0.1081
• Residual factor for significantly intense reflections: 0.0443
• Weighted residual factors for significantly intense reflections: 0.0586
• Weighted residual factors for all reflections included in the refinement: 0.0716
• Goodness-of-fit parameter for all reflections included in the refinement: 1.005
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No