Information card for entry 4347331

Structure parameters

• Formula: C35 H55 Cl2 N3 Si
• Calculated formula: C35 H55 Cl2 N3 Si
• SMILES: [Si](Cl)(Cl)(C1C(C)(C)CC(C)(C)N1c1c(C(C)C)cccc1C(C)C)N(C(C)(C)C)/C(=N/C(C)(C)C)c1ccccc1
• Title of publication: Insertion of Cyclic Alkyl(amino) Carbene into the Si-H Bonds of Hydrochlorosilanes.
• Authors of publication: Mohapatra, Chandrajeet; Samuel, Prinson P.; Li, Bin; Niepötter, Benedikt; Schürmann, Christian J; Herbst-Irmer, Regine; Stalke, Dietmar; Maity, Bholanath; Koley, Debasis; Roesky, Herbert W.
• Journal of publication: Inorganic chemistry
• Year of publication: 2016
• Journal volume: 55
• Journal issue: 5
• Pages of publication: 1953 - 1955
• a: 13.314 ± 0.002 Å
• b: 16.57 ± 0.002 Å
• c: 17.34 ± 0.003 Å
• α: 90°
• β: 112.38 ± 0.02°
• γ: 90°
• Cell volume: 3537.3 ± 1 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 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: 0.0504
• Residual factor for significantly intense reflections: 0.0355
• Weighted residual factors for significantly intense reflections: 0.0776
• Weighted residual factors for all reflections included in the refinement: 0.0841
• Goodness-of-fit parameter for all reflections included in the refinement: 1.028
• Diffraction radiation wavelength: 0.56086 Å
• Diffraction radiation type: AgKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No