Information card for entry 7013452

Structure parameters

• Formula: C20 H29 Cl4 N3 Pd
• Calculated formula: C20 H29 Cl4 N3 Pd
• SMILES: [Pd]1(Cl)(Cl)[N](c2c(cccc2C(C)C)C(C)C)=C(C)CN2C=CN(C)C=12.ClCCl
• Title of publication: Synthesis and characterization of palladium(II) complexes with a novel chelating iminocarbene ligand
• Authors of publication: Morten Frøseth; Ajaib Dhindsa; Hilde Røise; Mats Tilset
• Journal of publication: Dalton Trans.
• Year of publication: 2003
• Journal issue: 23
• Pages of publication: 4516 - 4524
• a: 13.325 ± 0.003 Å
• b: 14.218 ± 0.003 Å
• c: 25.334 ± 0.005 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 4799.6 ± 1.8 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 5
• Space group number: 61
• Hermann-Mauguin space group symbol: P b c a
• Hall space group symbol: -P 2ac 2ab
• Residual factor for all reflections: 0.0978
• Residual factor for significantly intense reflections: 0.0538
• Weighted residual factors for all reflections: 0.1568
• Weighted residual factors for significantly intense reflections: 0.1228
• Goodness-of-fit parameter for all reflections: 1.197
• Goodness-of-fit parameter for significantly intense reflections: 1.15
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No