Information card for entry 4104459

Structure parameters

• Common name: (C6F5)3B-LSi=Ni(CO)3 * 1/2 toluene
• Formula: C107 H88 B2 F30 N4 Ni2 O6 Si2
• Calculated formula: C107 H88 B2 F30 N4 Ni2 O6 Si2
• SMILES: [Ni]([Si]1N(C(=CC(=[N]1c1c(cccc1C(C)C)C(C)C)C[B](c1c(c(c(c(c1F)F)F)F)F)(c1c(c(c(c(c1F)F)F)F)F)c1c(c(c(c(c1F)F)F)F)F)C)c1c(cccc1C(C)C)C(C)C)(C#[O])(C#[O])C#[O].c1ccccc1C
• Title of publication: Diketiminate Silicon(II) and Related NHSi Ligands Generated in the Coordination Sphere of Nickel(0)
• Authors of publication: Antje Meltzer; Carsten Präsang; Matthias Driess
• Journal of publication: Journal of the American Chemical Society
• Year of publication: 2009
• Journal volume: 131
• Pages of publication: 7232 - 7233
• a: 14.6855 ± 0.0003 Å
• b: 20.2466 ± 0.0007 Å
• c: 20.5691 ± 0.0007 Å
• α: 64.292 ± 0.003°
• β: 71.71 ± 0.003°
• γ: 87.14 ± 0.002°
• Cell volume: 5205.4 ± 0.3 ų
• Cell temperature: 150 ± 2 K
• Ambient diffraction temperature: 150 ± 2 K
• Number of distinct elements: 8
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.1135
• Residual factor for significantly intense reflections: 0.0603
• Weighted residual factors for significantly intense reflections: 0.1148
• Weighted residual factors for all reflections included in the refinement: 0.1271
• Goodness-of-fit parameter for all reflections included in the refinement: 1.073
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No