Information card for entry 7018366

Structure parameters

• Chemical name: DP-3-1-1 [1-(benzoquinoline imine)-2-amino-cyclohexane]2 Ni (OTf)2 (MeOH)
• Formula: C44 H44 F6 N6 Ni O7 S2
• Calculated formula: C44.002 H44.006 F6 N6 Ni O7.001 S2
• Title of publication: Mono- and dinuclear nickel(ii) complexes of resolved Schiff-base ligands with extended quinoline substituents.
• Authors of publication: Prema, Dipesh; Oshin, Kayode; Desper, John; Levy, Christopher J.
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2012
• Journal volume: 41
• Journal issue: 16
• Pages of publication: 4998 - 5009
• a: 12.3347 ± 0.0012 Å
• b: 12.8896 ± 0.0013 Å
• c: 17.0469 ± 0.0017 Å
• α: 86.508 ± 0.001°
• β: 73.82 ± 0.001°
• γ: 62.964 ± 0.001°
• Cell volume: 2311.6 ± 0.4 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 7
• Space group number: 1
• Hermann-Mauguin space group symbol: P 1
• Hall space group symbol: P 1
• Residual factor for all reflections: 0.0948
• Residual factor for significantly intense reflections: 0.0895
• Weighted residual factors for significantly intense reflections: 0.253
• Weighted residual factors for all reflections included in the refinement: 0.2594
• Goodness-of-fit parameter for all reflections included in the refinement: 1.501
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No