Information card for entry 7038298

Structure parameters

• Formula: C28 H14 F10 Hg N2 Ni O2
• Calculated formula: C28 H14 F10 Hg N2 Ni O2
• Title of publication: Supramolecular aggregation of Ni(salen) with (C6F5)2Hg and [o-C6F4Hg]3.
• Authors of publication: Tsunoda, Mitsukimi; Fleischmann, Martin; Jones, J. Stuart; Bhuvanesh, Nattamai; Scheer, Manfred; Gabbaï, François P
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2016
• Journal volume: 45
• Journal issue: 12
• Pages of publication: 5045 - 5051
• a: 7.1203 ± 0.0007 Å
• b: 24.87 ± 0.002 Å
• c: 14.1415 ± 0.0015 Å
• α: 90°
• β: 92.806 ± 0.007°
• γ: 90°
• Cell volume: 2501.2 ± 0.4 ų
• Cell temperature: 110.15 K
• Ambient diffraction temperature: 110.15 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: 0.1273
• Residual factor for significantly intense reflections: 0.0766
• Weighted residual factors for significantly intense reflections: 0.1657
• Weighted residual factors for all reflections included in the refinement: 0.1936
• Goodness-of-fit parameter for all reflections included in the refinement: 1.137
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No