Information card for entry 4347292

Structure parameters

• Formula: C74 H86 Ga N2 Ni
• Calculated formula: C74 H86 Ga N2 Ni
• Title of publication: [Cp(Ar)Ni{Ga(nacnac)}]: An Open-Shell Nickel(I) Complex Supported by a Gallium(I) Carbenoid (Cp(Ar) = C5(C6H4-4-Et)5, nacnac = HC[C(Me)N-(C6H3)-2,6-iPr2]2).
• Authors of publication: Chakraborty, Uttam; Mühldorf, Bernd; van Velzen, Niels J. C.; de Bruin, Bas; Harder, Sjoerd; Wolf, Robert
• Journal of publication: Inorganic chemistry
• Year of publication: 2016
• Journal volume: 55
• Journal issue: 6
• Pages of publication: 3075 - 3078
• a: 24.54658 ± 0.00018 Å
• b: 11.25766 ± 0.00008 Å
• c: 22.79169 ± 0.00015 Å
• α: 90°
• β: 98.946 ± 0.0007°
• γ: 90°
• Cell volume: 6221.57 ± 0.08 ų
• Cell temperature: 124 ± 1 K
• Ambient diffraction temperature: 124 ± 1 K
• Number of distinct elements: 5
• Space group number: 13
• Hermann-Mauguin space group symbol: P 1 2/c 1
• Hall space group symbol: -P 2yc
• Residual factor for all reflections: 0.0382
• Residual factor for significantly intense reflections: 0.033
• Weighted residual factors for significantly intense reflections: 0.0818
• Weighted residual factors for all reflections included in the refinement: 0.086
• Goodness-of-fit parameter for all reflections included in the refinement: 1.029
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 1.54184 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No