Information card for entry 2228770

Structure parameters

• Chemical name: Dichlorido(η^6^-<i>p</i>-cymene)(4-fluoroaniline-κ<i>N</i>)ruthenium(II)
• Formula: C16 H20 Cl2 F N Ru
• Calculated formula: C16 H20 Cl2 F N Ru
• SMILES: [Ru]12345(Cl)(Cl)([NH2]c6ccc(F)cc6)[c]6([cH]1[cH]2[c]3([cH]4[cH]56)C)C(C)C
• Title of publication: Dichlorido(η^6^-<i>p</i>-cymene)(4-fluoroaniline-κ<i>N</i>)ruthenium(II)
• Authors of publication: Sykora, Richard E.; Harris, Andrew G.; Clements, Jason W.; Hoffman, Norris W.
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2011
• Journal volume: 67
• Journal issue: 1
• Pages of publication: m99 - m100
• a: 8.6492 ± 0.0009 Å
• b: 12.2458 ± 0.0013 Å
• c: 15.6471 ± 0.0016 Å
• α: 90°
• β: 93.271 ± 0.008°
• γ: 90°
• Cell volume: 1654.6 ± 0.3 ų
• Cell temperature: 290 ± 2 K
• Ambient diffraction temperature: 290 ± 2 K
• Number of distinct elements: 6
• 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: 0.0585
• Residual factor for significantly intense reflections: 0.0335
• Weighted residual factors for significantly intense reflections: 0.0821
• Weighted residual factors for all reflections included in the refinement: 0.0904
• Goodness-of-fit parameter for all reflections included in the refinement: 1.002
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes