Information card for entry 2224372

Structure parameters

• Chemical name: Tetraethylammonium trichlorido(η^6^-<i>p</i>-cymene)ruthenate(II)
• Formula: C18 H34 Cl3 N Ru
• Calculated formula: C18 H34 Cl3 N Ru
• SMILES: [Ru]12345(Cl)(Cl)(Cl)[c]6([cH]1[cH]2[c]3([cH]4[cH]56)C(C)C)C.[N+](CC)(CC)(CC)CC
• Title of publication: Tetraethylammonium trichlorido(η^6^-<i>p</i>-cymene)ruthenate(II)
• Authors of publication: Wu, Fang-Hui; Lu, Lude; Duan, Taike; Zhang, Qian-Feng
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2009
• Journal volume: 65
• Journal issue: 12
• Pages of publication: m1695
• a: 9.584 ± 0.0001 Å
• b: 22.3797 ± 0.0002 Å
• c: 10.2071 ± 0.0001 Å
• α: 90°
• β: 98.668 ± 0.001°
• γ: 90°
• Cell volume: 2164.29 ± 0.04 ų
• Cell temperature: 296 ± 2 K
• Ambient diffraction temperature: 296 ± 2 K
• Number of distinct elements: 5
• 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: 0.0285
• Residual factor for significantly intense reflections: 0.0228
• Weighted residual factors for significantly intense reflections: 0.0533
• Weighted residual factors for all reflections included in the refinement: 0.0559
• Goodness-of-fit parameter for all reflections included in the refinement: 1.019
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes