Information card for entry 4070434

Structure parameters

• Chemical name: Bis((μ^3^-bromido)-bis(tetrahydrofuran-O-)-(μ^2^-lithium)-(N,N'- bis(2,6-di-isopropylphenyl)pentan-2,4-di-iminato-N,N')-nickel(I))
• Formula: C74 H114 Br2 Li2 N4 Ni2 O4
• Calculated formula: C74 H114 Br2 Li2 N4 Ni2 O4
• Title of publication: β-Diketiminato Nickel(I) Complexes with Very Weak Ligation Allowing for H2and N2Activation
• Authors of publication: Pfirrmann, Stefan; Yao, Shenglai; Ziemer, Burkhard; Stösser, Reinhard; Driess, Matthias; Limberg, Christian
• Journal of publication: Organometallics
• Year of publication: 2009
• Journal volume: 28
• Journal issue: 24
• Pages of publication: 6855
• a: 21.8673 ± 0.0006 Å
• b: 19.8655 ± 0.0005 Å
• c: 17.5029 ± 0.0005 Å
• α: 90°
• β: 91.549 ± 0.002°
• γ: 90°
• Cell volume: 7600.6 ± 0.4 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 7
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/c 1
• Hall space group symbol: -P 2ybc
• Residual factor for all reflections: 0.1682
• Residual factor for significantly intense reflections: 0.0685
• Weighted residual factors for significantly intense reflections: 0.1006
• Weighted residual factors for all reflections included in the refinement: 0.1241
• Goodness-of-fit parameter for all reflections included in the refinement: 0.819
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No