Information card for entry 7121130

Structure parameters

• Chemical name: Chlorido(7-chloro-8-hydroxyquinolinolato-5,6-dione-?N1,?O8)(?5-pentamethylcyclopentadienyl)rhodium(III),
• Formula: C19 H18 Cl2 N O3 Rh
• Calculated formula: C19 H18 Cl2 N O3 Rh
• SMILES: c12c3ccc[n]2[Rh]2456([c]7(C)[c]2([c]4(C)[c]5(C)[c]67C)C)(OC1=C(C(=O)C3=O)Cl)Cl
• Title of publication: Quinoline-para-quinones and metals: coordination-assisted formation of quinoline-ortho-quinones.
• Authors of publication: Kubanik, Mario; Lam, Nelson Y. S.; Holtkamp, Hannah U.; Söhnel, Tilo; Anderson, Robert F.; Jamieson, Stephen M. F.; Hartinger, Christian G.
• Journal of publication: Chemical communications (Cambridge, England)
• Year of publication: 2018
• Journal volume: 54
• Journal issue: 8
• Pages of publication: 992 - 995
• a: 14.473 ± 0.0007 Å
• b: 7.3041 ± 0.0003 Å
• c: 17.2691 ± 0.0008 Å
• α: 90°
• β: 92.709 ± 0.003°
• γ: 90°
• Cell volume: 1823.52 ± 0.14 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 6
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/c 1
• Hall space group symbol: -P 2ybc
• Residual factor for all reflections: 0.0638
• Residual factor for significantly intense reflections: 0.0492
• Weighted residual factors for significantly intense reflections: 0.1107
• Weighted residual factors for all reflections included in the refinement: 0.1178
• Goodness-of-fit parameter for all reflections included in the refinement: 1.055
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No