Information card for entry 7113948

Structure parameters

• Formula: C5 H12 Cl2 N2 Si
• Calculated formula: C5 H12 Cl2 N2 Si
• SMILES: [SiH2](Cl)(Cl)=C1N(CCN1C)C
• Title of publication: Pentacoordinate silicon(IV): cationic, anionic and neutral complexes derived from the reaction of NHC>SiCl4 with highly Lewis acidic (C2F5)2SiH2
• Authors of publication: T. Bottcher; S. Steinhauer; B. Neumann; H-G. Stammler; G.-V. Roschenthaler; B. Hoge
• Journal of publication: Chem.Commun.
• Year of publication: 2014
• Journal volume: 50
• Pages of publication: 6204
• a: 9.9722 ± 0.0003 Å
• b: 12.277 ± 0.0003 Å
• c: 7.76332 ± 0.00014 Å
• α: 90°
• β: 90.02 ± 0.002°
• γ: 90°
• Cell volume: 950.45 ± 0.04 ų
• Cell temperature: 99.99 ± 0.1 K
• Ambient diffraction temperature: 99.99 ± 0.1 K
• Number of distinct elements: 5
• 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: 0.0528
• Residual factor for significantly intense reflections: 0.0507
• Weighted residual factors for significantly intense reflections: 0.1306
• Weighted residual factors for all reflections included in the refinement: 0.1323
• Goodness-of-fit parameter for all reflections included in the refinement: 1.057
• Diffraction radiation wavelength: 0.7107 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No