Information card for entry 7018761

Structure parameters

• Formula: C24 H20 N2 O2 Pd
• Calculated formula: C24 H20 N2 O2 Pd
• SMILES: [Pd]12(c3c(c4[n]2cccc4)n(c2c3cccc2)c2ccccc2)OC(=CC(=[O]1)C)C
• Title of publication: Ru-Pt and Ru-Pd heterobimetallic complexes based on a new ligand with two distinct chelate sites.
• Authors of publication: Wang, Nan; Lu, Jia-Sheng; McCormick, Theresa M.; Wang, Suning
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2012
• Journal volume: 41
• Journal issue: 18
• Pages of publication: 5553 - 5561
• a: 12.1096 ± 0.0018 Å
• b: 12.2832 ± 0.0018 Å
• c: 13.777 ± 0.002 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 2049.3 ± 0.5 ų
• Cell temperature: 298 ± 2 K
• Ambient diffraction temperature: 298 ± 2 K
• Number of distinct elements: 5
• Space group number: 19
• Hermann-Mauguin space group symbol: P 21 21 21
• Hall space group symbol: P 2ac 2ab
• Residual factor for all reflections: 0.072
• Residual factor for significantly intense reflections: 0.0497
• Weighted residual factors for significantly intense reflections: 0.1159
• Weighted residual factors for all reflections included in the refinement: 0.1316
• Goodness-of-fit parameter for all reflections included in the refinement: 1.074
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No