Information card for entry 2244098

Structure parameters

• Chemical name: Dichlorido(4-methylaniline-κ<i>N</i>)[<i>N</i>-(4-methylphenyl)-1-(thiophen-2-yl)methanimine-κ<i>N</i>]palladium(II)
• Formula: C19 H20 Cl2 N2 Pd S
• Calculated formula: C19 H20 Cl2 N2 Pd S
• SMILES: [Pd](Cl)(Cl)([N](=Cc1sccc1)c1ccc(cc1)C)[NH2]c1ccc(cc1)C
• Title of publication: Dichlorido(4-methylaniline-κ<i>N</i>)[<i>N</i>-(4-methylphenyl)-1-(thiophen-2-yl)methanimine-κ<i>N</i>]palladium(II)
• Authors of publication: Butcher, Ray J.; Singh, Puspendra; Shabbani, Gulam
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2022
• Journal volume: 78
• Journal issue: 6
• Pages of publication: 1 - 0
• a: 9.2135 ± 0.0004 Å
• b: 9.406 ± 0.0004 Å
• c: 12.9032 ± 0.0005 Å
• α: 79.866 ± 0.002°
• β: 70 ± 0.002°
• γ: 67.753 ± 0.002°
• Cell volume: 971.17 ± 0.07 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 6
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.085
• Residual factor for significantly intense reflections: 0.0454
• Weighted residual factors for significantly intense reflections: 0.0792
• Weighted residual factors for all reflections included in the refinement: 0.0897
• Goodness-of-fit parameter for all reflections included in the refinement: 1.041
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes