Information card for entry 7037439

Structure parameters

• Formula: C31 H44 Cl4 N2 O Si
• Calculated formula: C31 H44 Cl4 N2 O Si
• SMILES: [Si](Cl)(Cl)(Cl)(Cl)c1[n+](cn(c1)c1c(cccc1C(C)C)C(C)C)c1c(cccc1C(C)C)C(C)C.O1CCCC1
• Title of publication: Abnormal carbene-silicon halide complexes.
• Authors of publication: Wang, Yuzhong; Xie, Yaoming; Wei, Pingrong; Schaefer, Henry F.; Robinson, Gregory H.
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2016
• Journal volume: 45
• Journal issue: 14
• Pages of publication: 5941 - 5944
• a: 11.77 ± 0.002 Å
• b: 18 ± 0.003 Å
• c: 17.322 ± 0.003 Å
• α: 90°
• β: 109.493 ± 0.002°
• γ: 90°
• Cell volume: 3459.5 ± 1 ų
• Cell temperature: 296 ± 2 K
• Ambient diffraction temperature: 296 ± 2 K
• Number of distinct elements: 6
• 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: 0.1458
• Residual factor for significantly intense reflections: 0.0654
• Weighted residual factors for significantly intense reflections: 0.1499
• Weighted residual factors for all reflections included in the refinement: 0.1938
• Goodness-of-fit parameter for all reflections included in the refinement: 1.011
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No