Information card for entry 2209202

Structure parameters

• Chemical name: Dichloro{P,P'-[3,3'-oxybis(m- phenylenemethylene)]bis(diphenylphosphine)}palladium(II)
• Formula: C38 H32 Cl2 O P2 Pd
• Calculated formula: C38 H32 Cl2 O P2 Pd
• SMILES: C1c2cccc(c2)Oc2cccc(c2)C[P](c2ccccc2)(c2ccccc2)[Pd]([P]1(c1ccccc1)c1ccccc1)(Cl)Cl
• Title of publication: <i>trans</i>-Dichloro{<i>P</i>,<i>P</i>'-[3,3'-oxybis(<i>m</i>-phenylenemethylene)]bis(diphenylphosphine)}palladium(II)
• Authors of publication: Chahen, Ludovic; Therrien, Bruno; Süss-Fink, Georg
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2006
• Journal volume: 62
• Journal issue: 6
• Pages of publication: m1270 - m1271
• a: 11.417 ± 0.0005 Å
• b: 20.8796 ± 0.0017 Å
• c: 27.6747 ± 0.0013 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 6597.2 ± 0.7 ų
• Cell temperature: 203 ± 2 K
• Ambient diffraction temperature: 203 ± 2 K
• Number of distinct elements: 6
• Space group number: 61
• Hermann-Mauguin space group symbol: P b c a
• Hall space group symbol: -P 2ac 2ab
• Residual factor for all reflections: 0.0859
• Residual factor for significantly intense reflections: 0.0369
• Weighted residual factors for significantly intense reflections: 0.0643
• Weighted residual factors for all reflections included in the refinement: 0.0744
• Goodness-of-fit parameter for all reflections included in the refinement: 0.822
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes