Information card for entry 7018580

Structure parameters

• Formula: C39 H52 Br2 N2 O Si2 Zn
• Calculated formula: C39 H52 Br2 N2 O Si2 Zn
• SMILES: Br[Zn]1(Br)[N](C)(C)[C@@H]2CCCC[C@H]2[N]1(C)C[Si](c1ccccc1)(c1ccccc1)C[Si](c1ccccc1)(c1ccccc1)C.C(=O)(C)C
• Title of publication: Preparation of aminomethyl functionalised silanes via an α-lithiated amine: From their synthesis, stability and crystal structures to stereochemical issues.
• Authors of publication: Gessner, Viktoria H.; Strohmann, Carsten
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2012
• Journal volume: 41
• Journal issue: 12
• Pages of publication: 3452 - 3460
• a: 12.2947 ± 0.0004 Å
• b: 16.4427 ± 0.0005 Å
• c: 19.7658 ± 0.0006 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 3995.8 ± 0.2 ų
• Cell temperature: 173 ± 2 K
• Ambient diffraction temperature: 173 ± 2 K
• Number of distinct elements: 7
• Space group number: 19
• Hermann-Mauguin space group symbol: P 21 21 21
• Hall space group symbol: P 2ac 2ab
• Residual factor for all reflections: 0.0351
• Residual factor for significantly intense reflections: 0.0255
• Weighted residual factors for significantly intense reflections: 0.0392
• Weighted residual factors for all reflections included in the refinement: 0.0397
• Goodness-of-fit parameter for all reflections included in the refinement: 1.016
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No