Information card for entry 4305730

Structure parameters

• Formula: C23 H28 Cl3 N2 O4 Rh
• Calculated formula: C23 H28 Cl3 N2 O4 Rh
• SMILES: [Rh]12(Cl)(C(Cl)Cl)([N](=Cc3cccc[n]13)c1ccc(cc1)OC)OC(=CC(C)=[O]2)C.C1CCCO1
• Title of publication: Synthesis, Characterization, and Reactivity of Rhodium(I) Acetylacetonato Complexes Containing Pyridinecarboxaldimine Ligands
• Authors of publication: Diane A. Kanas; Stephen J. Geier; Christopher M. Vogels; Andreas Decken; Stephen A. Westcott
• Journal of publication: Inorganic Chemistry
• Year of publication: 2008
• Journal volume: 47
• Pages of publication: 8727 - 8735
• a: 13.268 ± 0.008 Å
• b: 13.693 ± 0.008 Å
• c: 14.352 ± 0.009 Å
• α: 90°
• β: 104.815 ± 0.009°
• γ: 90°
• Cell volume: 2521 ± 3 ų
• Cell temperature: 173 ± 1 K
• Ambient diffraction temperature: 173 ± 1 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: 0.0891
• Residual factor for significantly intense reflections: 0.0428
• Weighted residual factors for significantly intense reflections: 0.0883
• Weighted residual factors for all reflections included in the refinement: 0.1101
• Goodness-of-fit parameter for all reflections included in the refinement: 1.074
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No