Information card for entry 4064597

Structure parameters

• Formula: C49 H63 Cl N6 Si2
• Calculated formula: C49 H62.998 Cl1.002 N6 Si2
• Title of publication: Formation of a Unsymmetrical Ring System via C‒H Bond Activation of Diazobenzene by Stable N-Heterocyclic Chlorosilylene (PhC(NtBu)2SiCl)
• Authors of publication: Khan, Shabana; Sen, Sakya S.; Michel, Reent; Kratzert, Daniel; Roesky, Herbert W.; Stalke, Dietmar
• Journal of publication: Organometallics
• Year of publication: 2011
• Journal volume: 30
• Journal issue: 10
• Pages of publication: 2643
• a: 9.3427 ± 0.0011 Å
• b: 10.7563 ± 0.0013 Å
• c: 12.2182 ± 0.0015 Å
• α: 94.31 ± 0.002°
• β: 97.304 ± 0.002°
• γ: 108.196 ± 0.002°
• Cell volume: 1148.4 ± 0.2 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 5
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0646
• Residual factor for significantly intense reflections: 0.0611
• Weighted residual factors for significantly intense reflections: 0.1343
• Weighted residual factors for all reflections included in the refinement: 0.1357
• Goodness-of-fit parameter for all reflections included in the refinement: 1.196
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No