Information card for entry 7232257

Structure parameters

• Formula: C16 H18 F6 N2 Ni O4
• Calculated formula: C16 H18 F6 N2 Ni O4
• Title of publication: Synthesis and characterisation of κ2-N,O-oxazoline-enolate complexes of nickel(ii): explorations in coordination chemistry and metal-mediated polymerisation
• Authors of publication: Adjei, Jeanette A.; Lough, Alan J.; Gossage, Robert A.
• Journal of publication: RSC Advances
• Year of publication: 2019
• Journal volume: 9
• Journal issue: 7
• Pages of publication: 3956
• a: 11.1193 ± 0.0004 Å
• b: 18.3316 ± 0.0008 Å
• c: 19.041 ± 0.0008 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 3881.2 ± 0.3 ų
• Cell temperature: 150 ± 2 K
• Ambient diffraction temperature: 150 ± 2 K
• Number of distinct elements: 6
• 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: 0.0735
• Residual factor for significantly intense reflections: 0.0386
• Weighted residual factors for significantly intense reflections: 0.0679
• Weighted residual factors for all reflections included in the refinement: 0.0789
• Goodness-of-fit parameter for all reflections included in the refinement: 0.993
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No