Information card for entry 4071116

Structure parameters

• Formula: C25 H33 Li Ni O2
• Calculated formula: C25 H33 Li Ni O2
• SMILES: [Ni]123456([Li]([C]72=CC=CC=C7c2c1cccc2)([O](CC)CC)[O](CC)CC)[cH]1[cH]3[cH]4[cH]5[cH]61
• Title of publication: Synthesis and Structures of 9-Nickelafluorenyllithium Complexes
• Authors of publication: Buchalski, Piotr; Grabowska, Ilona; Kamińska, Elżbieta; Suwińska, Kinga
• Journal of publication: Organometallics
• Year of publication: 2008
• Journal volume: 27
• Journal issue: 10
• Pages of publication: 2346
• a: 9.8482 ± 0.0003 Å
• b: 14.5816 ± 0.0004 Å
• c: 15.6829 ± 0.0005 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 2252.1 ± 0.12 ų
• Cell temperature: 120 ± 2 K
• Ambient diffraction temperature: 120 ± 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: 0.0604
• Residual factor for significantly intense reflections: 0.0428
• Weighted residual factors for significantly intense reflections: 0.0727
• Weighted residual factors for all reflections included in the refinement: 0.0763
• Goodness-of-fit parameter for all reflections included in the refinement: 1.028
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No