Information card for entry 2015345

Structure parameters

• Chemical name: Ferrocene‒decafluorobiphenyl (1/1)
• Formula: C22 H10 F10 Fe
• Calculated formula: C22 H10 F10 Fe
• Title of publication: Arene‒perfluoroarene interactions in crystal engineering. XV. Ferrocene‒decafluorobiphenyl (1/1)
• Authors of publication: Batsanov, Andrei S.; Collings, Jonathan C.; Marder, Todd B.
• Journal of publication: Acta Crystallographica Section C
• Year of publication: 2006
• Journal volume: 62
• Journal issue: 6
• Pages of publication: m229 - m231
• a: 13.3025 ± 0.0012 Å
• b: 6.169 ± 0.0006 Å
• c: 23.026 ± 0.002 Å
• α: 90°
• β: 98.69 ± 0.01°
• γ: 90°
• Cell volume: 1867.9 ± 0.3 ų
• Cell temperature: 120 ± 2 K
• Ambient diffraction temperature: 120 ± 2 K
• Number of distinct elements: 4
• Space group number: 15
• Hermann-Mauguin space group symbol: C 1 2/c 1
• Hall space group symbol: -C 2yc
• Residual factor for all reflections: 0.0536
• Residual factor for significantly intense reflections: 0.0389
• Weighted residual factors for significantly intense reflections: 0.0911
• Weighted residual factors for all reflections included in the refinement: 0.0978
• Goodness-of-fit parameter for all reflections included in the refinement: 1.061
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: Yes