Information card for entry 2237228

Structure parameters

• Chemical name: (Benzyl isocyanide-κ<i>C</i>^1^)chlorido(2-chloro-3-dimethylamino-1-phenylprop- 1-en-1-yl-κ^2^<i>C</i>^1^,<i>N</i>)palladium(II)
• Formula: C19 H20 Cl2 N2 Pd
• Calculated formula: C19 H20 Cl2 N2 Pd
• SMILES: [Pd]1(C(c2ccccc2)=C(Cl)C[N]1(C)C)(Cl)C#[N]Cc1ccccc1
• Title of publication: (Benzyl isocyanide-κ<i>C</i>^1^)chlorido(2-chloro-3-dimethylamino-1-phenylprop-1-en-1-yl-κ^2^<i>C</i>^1^,<i>N</i>)palladium(II)
• Authors of publication: Mafud, Ana C.; Oliviera, Milene A. R.; Gambardella, Maria T. P.
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2013
• Journal volume: 69
• Journal issue: 1
• Pages of publication: m36
• a: 6.2529 ± 0.0007 Å
• b: 11.0931 ± 0.001 Å
• c: 27.64 ± 0.002 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 1917.2 ± 0.3 ų
• Cell temperature: 290 ± 2 K
• Ambient diffraction temperature: 290 ± 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: 0.0891
• Residual factor for significantly intense reflections: 0.0389
• Weighted residual factors for all reflections included in the refinement: 0.0854
• Goodness-of-fit parameter for all reflections included in the refinement: 1.029
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes