Information card for entry 2237822

Structure parameters

• Chemical name: Dichlorido{2,6-diisopropyl-<i>N</i>-[(<i>S</i>)-pyrrolidin-2-ylmethyl]aniline-κ^2^<i>N</i>,<i>N</i>'}palladium(II)
• Formula: C17 H28 Cl2 N2 Pd
• Calculated formula: C17 H28 Cl2 N2 Pd
• SMILES: [Pd]1(Cl)(Cl)[NH]2CCCC2C[NH]1c1c(C(C)C)cccc1C(C)C
• Title of publication: Dichlorido{2,6-diisopropyl-<i>N</i>-[(<i>S</i>)-pyrrolidin-2-ylmethyl]aniline-κ^2^<i>N</i>,<i>N</i>'}palladium(II)
• Authors of publication: Nayab, Saira; Lee, Hong-In; Jeong, Jong Hwa
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2013
• Journal volume: 69
• Journal issue: 5
• Pages of publication: m238 - m239
• a: 24.287 ± 0.003 Å
• b: 8.6534 ± 0.0012 Å
• c: 18.355 ± 0.002 Å
• α: 90°
• β: 94.851 ± 0.009°
• γ: 90°
• Cell volume: 3843.8 ± 0.8 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 5
• Space group number: 15
• Hermann-Mauguin space group symbol: C 1 2/c 1
• Hall space group symbol: -C 2yc
• Residual factor for all reflections: 0.0453
• Residual factor for significantly intense reflections: 0.038
• Weighted residual factors for significantly intense reflections: 0.1031
• Weighted residual factors for all reflections included in the refinement: 0.1053
• Goodness-of-fit parameter for all reflections included in the refinement: 1.077
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes