Information card for entry 2241612

Structure parameters

• Chemical name: <i>trans</i>-Dichlorido[3-methyl-1-(4-vinylbenzyl)-1<i>H</i>-imidazol-3-ium-2-yl-κ<i>C</i>^2^](4-phenylpyridine-κ<i>N</i>)palladium(II)
• Formula: C24 H23 Cl2 N3 Pd
• Calculated formula: C24 H23 Cl2 N3 Pd
• SMILES: [Pd](Cl)(Cl)([n]1ccc(c2ccccc2)cc1)=C1N(Cc2ccc(C=C)cc2)C=CN1C
• Title of publication: Synthesis and crystal structure of <i>trans</i>-dichlorido[3-methyl-1-(4-vinylbenzyl)-1<i>H</i>-imidazol-3-ium-2-yl-κ<i>C</i>^2^](4-phenylpyridine-κ<i>N</i>)palladium(II)
• Authors of publication: Majeed, Maitham H.; Wendt, Ola F.
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2016
• Journal volume: 72
• Journal issue: 4
• Pages of publication: 534 - 537
• a: 7.8768 ± 0.0003 Å
• b: 12.2939 ± 0.0005 Å
• c: 12.612 ± 0.0004 Å
• α: 95.692 ± 0.003°
• β: 97.267 ± 0.003°
• γ: 103.574 ± 0.003°
• Cell volume: 1167.09 ± 0.08 ų
• Cell temperature: 183.05 ± 0.1 K
• Ambient diffraction temperature: 183.05 ± 0.1 K
• Number of distinct elements: 5
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0345
• Residual factor for significantly intense reflections: 0.0269
• Weighted residual factors for significantly intense reflections: 0.0629
• Weighted residual factors for all reflections included in the refinement: 0.0675
• Goodness-of-fit parameter for all reflections included in the refinement: 1.043
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes