Information card for entry 7036099

Structure parameters

• Formula: C32 H76 I2 Mg2 N2 O2 Si4
• Calculated formula: C32 H76 I2 Mg2 N2 O2 Si4
• SMILES: C[Si](C)(C(C)(C)C)N([Mg]1([I][Mg]([I]1)(N([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)[O]1CCCC1)[O]1CCCC1)[Si](C)(C)C(C)(C)C
• Title of publication: Salt metathesis versus protonolysis routes for the synthesis of silylamide Hauser base (R2NMgX; X = halogen) and amido-Grignard (R2NMgR) complexes.
• Authors of publication: Goodwin, Conrad A. P.; Smith, Alex; Ortu, Fabrizio; Vitorica-Yrezabal, Iñigo J; Mills, David P.
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2016
• Journal volume: 45
• Journal issue: 14
• Pages of publication: 6004 - 6014
• a: 31.4565 ± 0.0018 Å
• b: 10.5855 ± 0.0005 Å
• c: 14.2235 ± 0.0007 Å
• α: 90°
• β: 105.608 ± 0.005°
• γ: 90°
• Cell volume: 4561.5 ± 0.4 ų
• Cell temperature: 120 ± 2 K
• Ambient diffraction temperature: 120 ± 2 K
• Number of distinct elements: 7
• Space group number: 15
• Hermann-Mauguin space group symbol: C 1 2/c 1
• Hall space group symbol: -C 2yc
• Residual factor for all reflections: 0.0654
• Residual factor for significantly intense reflections: 0.0496
• Weighted residual factors for significantly intense reflections: 0.1271
• Weighted residual factors for all reflections included in the refinement: 0.1389
• Goodness-of-fit parameter for all reflections included in the refinement: 1.066
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No