Information card for entry 4066122

Structure parameters

• Formula: C29 H32 N2 O2 Pd
• Calculated formula: C29 H32 N2 O2 Pd
• SMILES: C[Pd]1([N](=Cc2c(O1)c1c(cc2)cccc1O)c1c(cccc1C(C)C)C(C)C)[n]1ccccc1
• Title of publication: Synthesis of (N−O)-Ligated Palladium(II) Complexes and Their Use in Ethene Homopolymerization and Norbornene Copolymerizations
• Authors of publication: Chen, Ying; Mandal, Sukhendu; Sen, Ayusman
• Journal of publication: Organometallics
• Year of publication: 2010
• Journal volume: 29
• Journal issue: 14
• Pages of publication: 3160
• a: 9.605 ± 0.002 Å
• b: 30.963 ± 0.007 Å
• c: 17.097 ± 0.004 Å
• α: 90°
• β: 96.724 ± 0.004°
• γ: 90°
• Cell volume: 5050 ± 2 ų
• Cell temperature: 120 ± 2 K
• Ambient diffraction temperature: 120 ± 2 K
• Number of distinct elements: 5
• 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: 0.1213
• Residual factor for significantly intense reflections: 0.0838
• Weighted residual factors for significantly intense reflections: 0.1736
• Weighted residual factors for all reflections included in the refinement: 0.1888
• Goodness-of-fit parameter for all reflections included in the refinement: 1.112
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No