Information card for entry 4083035

Structure parameters

• Formula: C54 H42 Cl10 Ni P2
• Calculated formula: C54.0004 H42.0004 Cl10.0012 Ni P2
• Title of publication: A Broadly Applicable Strategy for Entry into Homogeneous Nickel(0) Catalysts from Air-Stable Nickel(II) Complexes.
• Authors of publication: Standley, Eric A.; Smith, Stacey J.; Müller, Peter; Jamison, Timothy F.
• Journal of publication: Organometallics
• Year of publication: 2014
• Journal volume: 33
• Journal issue: 8
• Pages of publication: 2012 - 2018
• a: 12.7779 ± 0.001 Å
• b: 19.4532 ± 0.0015 Å
• c: 20.8196 ± 0.0016 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 5175.1 ± 0.7 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 5
• Space group number: 19
• Hermann-Mauguin space group symbol: P 21 21 21
• Hall space group symbol: P 2ac 2ab
• Residual factor for all reflections: 0.0351
• Residual factor for significantly intense reflections: 0.0328
• Weighted residual factors for significantly intense reflections: 0.0927
• Weighted residual factors for all reflections included in the refinement: 0.0938
• Goodness-of-fit parameter for all reflections included in the refinement: 1.059
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No