Information card for entry 2203018

Structure parameters

• Formula: C48 H42 Cl4 P2 Pd2
• Calculated formula: C48 H42 Cl4 P2 Pd2
• SMILES: [P](c1ccccc1)([Pd]1([Cl][Pd]([P](c2ccccc2)(c2ccccc2)c2ccccc2)([Cl]1)Cl)Cl)(c1ccccc1)c1ccccc1.c1ccccc1.c1ccccc1
• Title of publication: <i>trans</i>-Di-μ-chloro-bis[chloro(triphenylphosphine)palladium] benzene disolvate
• Authors of publication: Sui-Seng, Christine; Bélanger-Gariépy, Francine; Zargarian, Davit
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2003
• Journal volume: 59
• Journal issue: 8
• Pages of publication: m618 - m619
• a: 9.6895 ± 0.0002 Å
• b: 18.9619 ± 0.0003 Å
• c: 12.8905 ± 0.0002 Å
• α: 90°
• β: 109.743 ± 0.001°
• γ: 90°
• Cell volume: 2229.17 ± 0.07 ų
• Cell temperature: 220 ± 2 K
• Ambient diffraction temperature: 220 ± 2 K
• Number of distinct elements: 5
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/c 1
• Hall space group symbol: -P 2ybc
• Residual factor for all reflections: 0.037
• Residual factor for significantly intense reflections: 0.034
• Weighted residual factors for all reflections: 0.09
• Weighted residual factors for all reflections included in the refinement: 0.089
• Goodness-of-fit parameter for all reflections: 1.05
• Goodness-of-fit parameter for all reflections included in the refinement: 1.09
• Diffraction radiation wavelength: 1.54178 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes