Information card for entry 7009657

Structure parameters

• Chemical name: chloro-(8-hydroxyquinolinato-N,O)-(eta$6!-p-cymene)-ruthenium(II)
• Formula: C19 H20 Cl N O Ru
• Calculated formula: C19 H20 Cl N O Ru
• SMILES: [Ru]123456(Cl)([c]7([cH]1[cH]2[c]3([cH]4[cH]57)C(C)C)C)[n]1cccc2cccc(O6)c12
• Title of publication: Synthesis and characterization of ruthenium quinolin-8-olate complexes. Unexpected formation of a κ1-hydrotris(pyrazolyl)borate complex
• Authors of publication: Gemel, Christian; John, Roland; Slugovc, Christian; Mereiter, Kurt; Schmid, Roland; Kirchner, Karl
• Journal of publication: Journal of the Chemical Society, Dalton Transactions
• Year of publication: 2000
• Journal issue: 15
• Pages of publication: 2607
• a: 10.757 ± 0.002 Å
• b: 13.287 ± 0.003 Å
• c: 12.309 ± 0.002 Å
• α: 90°
• β: 102.97 ± 0.01°
• γ: 90°
• Cell volume: 1714.4 ± 0.6 ų
• Cell temperature: 300 ± 2 K
• Ambient diffraction temperature: 300 ± 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: 0.0272
• Residual factor for significantly intense reflections: 0.0202
• Weighted residual factors for all reflections: 0.0483
• Weighted residual factors for significantly intense reflections: 0.0431
• Goodness-of-fit parameter for all reflections: 1.037
• Goodness-of-fit parameter for significantly intense reflections: 1.049
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No