Information card for entry 2019192

Structure parameters

• Chemical name: (Hexafluorosilicato-κ^2^<i>F</i>,<i>F</i>')bis(1,10-phenanthroline-κ^2^<i>N</i>,<i>N</i>')zinc(II) methanol monosolvate
• Formula: C25 H20 F6 N4 O Si Zn
• Calculated formula: C25 H20 F6 N4 O Si Zn
• SMILES: [Zn]123([n]4c5c(ccc4)ccc4ccc[n]1c54)([n]1c4c(ccc1)ccc1ccc[n]2c41)[F][Si]([F]3)(F)(F)(F)F.OC
• Title of publication: (Hexafluorosilicato-κ^2^<i>F</i>,<i>F</i>')bis(1,10-phenanthroline-κ^2^<i>N</i>,<i>N</i>')zinc(II) methanol monosolvate
• Authors of publication: Seidel, Rüdiger W.; Dietz, Christina; Breidung, Jürgen; Goddard, Richard; Oppel, Iris M.
• Journal of publication: Acta Crystallographica Section C
• Year of publication: 2013
• Journal volume: 69
• Journal issue: 10
• Pages of publication: 1112 - 1115
• a: 11.3701 ± 0.0003 Å
• b: 12.7057 ± 0.0003 Å
• c: 16.3139 ± 0.0004 Å
• α: 90°
• β: 100.896 ± 0.002°
• γ: 90°
• Cell volume: 2314.3 ± 0.1 ų
• Cell temperature: 110 ± 2 K
• Ambient diffraction temperature: 110 ± 2 K
• Number of distinct elements: 7
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/n 1
• Hall space group symbol: -P 2yn
• Residual factor for all reflections: 0.0466
• Residual factor for significantly intense reflections: 0.0306
• Weighted residual factors for significantly intense reflections: 0.0655
• Weighted residual factors for all reflections included in the refinement: 0.0713
• Goodness-of-fit parameter for all reflections included in the refinement: 1.033
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No