Information card for entry 1540653

Structure parameters

• Formula: C30 H47 Cl N2 Pd
• Calculated formula: C30 H47 Cl N2 Pd
• SMILES: [Pd]1(Cl)([N](=C(C([NH]1c1c(C(C)C)cccc1C(C)C)(C)C)C)c1c(cccc1C(C)C)C(C)C)C
• Title of publication: Amine‒imine palladium catalysts for living polymerization of ethylene and copolymerization of ethylene with methyl acrylate: incorporation of acrylate units into the main chain and branch end
• Authors of publication: Hu, Haibin; Chen, Darui; Gao, Haiyang; Zhong, Liu; Wu, Qing
• Journal of publication: Polym. Chem.
• Year of publication: 2016
• Journal volume: 7
• Journal issue: 3
• Pages of publication: 529
• a: 15.919 ± 0.002 Å
• b: 11.3592 ± 0.0016 Å
• c: 17.894 ± 0.003 Å
• α: 90°
• β: 114.701 ± 0.002°
• γ: 90°
• Cell volume: 2939.7 ± 0.7 ų
• Cell temperature: 273 ± 2 K
• Ambient diffraction temperature: 273 ± 2 K
• Number of distinct elements: 5
• 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: 0.0506
• Residual factor for significantly intense reflections: 0.0308
• Weighted residual factors for significantly intense reflections: 0.0716
• Weighted residual factors for all reflections included in the refinement: 0.0807
• Goodness-of-fit parameter for all reflections included in the refinement: 1.021
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No