Information card for entry 2232342

Structure parameters

• Chemical name: (<i>SP</i>-4-2)-Chlorido{<i>N</i>-[2- (diphenylphosphanyl)benzylidene]benzylamine- κ^2^<i>P</i>,<i>N</i>}(methyl)palladium(II)
• Formula: C27 H25 Cl N P Pd
• Calculated formula: C27 H25 Cl N P Pd
• SMILES: [Pd]1(Cl)(C)[P](c2ccccc2)(c2ccccc2)c2ccccc2C=[N]1Cc1ccccc1
• Title of publication: (<i>SP</i>-4-2)-Chlorido{<i>N</i>-[2-(diphenylphosphanyl)benzylidene]benzylamine-κ^2^<i>P</i>,<i>N</i>}(methyl)palladium(II)
• Authors of publication: Chiririwa, Haleden; Meijboom, Reinout
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2011
• Journal volume: 67
• Journal issue: 11
• Pages of publication: m1498
• a: 10.0147 ± 0.0008 Å
• b: 21.8935 ± 0.0018 Å
• c: 10.7478 ± 0.0008 Å
• α: 90°
• β: 94.192 ± 0.002°
• γ: 90°
• Cell volume: 2350.2 ± 0.3 ų
• Cell temperature: 173 ± 2 K
• Ambient diffraction temperature: 173 ± 2 K
• Number of distinct elements: 6
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/n 1
• Hall space group symbol: -P 2yn
• Residual factor for all reflections: 0.0432
• Residual factor for significantly intense reflections: 0.0338
• Weighted residual factors for significantly intense reflections: 0.0859
• Weighted residual factors for all reflections included in the refinement: 0.0908
• Goodness-of-fit parameter for all reflections included in the refinement: 1.031
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes