Information card for entry 4067188

Structure parameters

• Formula: C20 H37 Cl Ni P2
• Calculated formula: C20 H37 Cl Ni P2
• SMILES: [Ni]1(Cl)([P](CC[P]1(C(C)C)C(C)C)(C(C)C)C(C)C)c1ccccc1
• Title of publication: Dehydrocoupling of Organosilanes with a Dinuclear Nickel Hydride Catalyst and Isolation of a Nickel Silyl Complex
• Authors of publication: Smith, Erin E.; Du, Guodong; Fanwick, Phillip E.; Abu-Omar, Mahdi M.
• Journal of publication: Organometallics
• Year of publication: 2010
• Journal volume: 29
• Journal issue: 23
• Pages of publication: 6527
• a: 15.9009 ± 0.0003 Å
• b: 14.0408 ± 0.0003 Å
• c: 19.9763 ± 0.0004 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 4459.94 ± 0.16 ų
• Cell temperature: 150 K
• Ambient diffraction temperature: 150 K
• Number of distinct elements: 5
• Space group number: 61
• Hermann-Mauguin space group symbol: P b c a
• Hall space group symbol: -P 2ac 2ab
• Residual factor for all reflections: 0.057
• Residual factor for significantly intense reflections: 0.034
• Weighted residual factors for significantly intense reflections: 0.074
• Weighted residual factors for all reflections included in the refinement: 0.08
• Goodness-of-fit parameter for all reflections included in the refinement: 1.02
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MO-Kα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No