Information card for entry 4068053

Structure parameters

• Formula: C31 H48 Cl4 N4 Si2
• Calculated formula: C31 H48 Cl4 N4 Si2
• SMILES: Cl[Si]1(Cl)([N](=C(N1C(C)(C)C)c1ccccc1)C(C)(C)C)C[Si]1(Cl)(Cl)[N](=C(N1C(C)(C)C)c1ccccc1)C(C)(C)C
• Title of publication: A Remarkable End-On Activation of Diazoalkane and Cleavage of Both C‒Cl Bonds of Dichloromethane with a Silylene to a Single Product with Five-Coordinate Silicon Atoms
• Authors of publication: Sen, Sakya S.; Hey, Jakob; Kratzert, Daniel; Roesky, Herbert W.; Stalke, Dietmar
• Journal of publication: Organometallics
• Year of publication: 2012
• Journal volume: 31
• Journal issue: 1
• Pages of publication: 435
• a: 14.8427 ± 0.0007 Å
• b: 13.6256 ± 0.0007 Å
• c: 17.5591 ± 0.0008 Å
• α: 90°
• β: 100.029 ± 0.002°
• γ: 90°
• Cell volume: 3496.9 ± 0.3 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: 0.0288
• Residual factor for significantly intense reflections: 0.0251
• Weighted residual factors for significantly intense reflections: 0.0655
• Weighted residual factors for all reflections included in the refinement: 0.0678
• Goodness-of-fit parameter for all reflections included in the refinement: 1.029
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No