Information card for entry 4306658

Structure parameters

• Formula: C36 H44 N2 Si Sn
• Calculated formula: C36 H44 N2 Si Sn
• SMILES: [Sn]1N([Si](N1c1c(cccc1C(C)C)C(C)C)(c1ccccc1)c1ccccc1)c1c(cccc1C(C)C)C(C)C
• Title of publication: Synthesis and Structural Characterization of Tin Analogues of N-Heterocyclic Carbenes
• Authors of publication: Stephen M. Mansell; Christopher A. Russell; Duncan F. Wass
• Journal of publication: Inorganic Chemistry
• Year of publication: 2008
• Journal volume: 47
• Pages of publication: 11367 - 11375
• a: 18.014 ± 0.004 Å
• b: 21.158 ± 0.004 Å
• c: 34.457 ± 0.007 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 13133 ± 5 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 5
• Space group number: 61
• Hermann-Mauguin space group symbol: P b c a
• Hall space group symbol: -P 2ac 2ab
• Residual factor for all reflections: 0.0613
• Residual factor for significantly intense reflections: 0.0434
• Weighted residual factors for significantly intense reflections: 0.0999
• Weighted residual factors for all reflections included in the refinement: 0.1171
• Goodness-of-fit parameter for all reflections included in the refinement: 1.138
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No