Information card for entry 2015736

Structure parameters

• Chemical name: chloro{diethoxy[2-(diphenylphosphino)phenyl]methane]methylpalladium(II)
• Formula: C24 H28 Cl O2 P Pd
• Calculated formula: C24 H28 Cl O2 P Pd
• SMILES: [Pd]1(C)(Cl)[O](CC)C(OCC)c2ccccc2[P]1(c1ccccc1)c1ccccc1
• Title of publication: Two square-planar palladium(II) complexes with <i>P</i>,<i>O</i>-bidentate hybrid ligands
• Authors of publication: Elsegood, Mark R. J.; Smith, Martin B.; Dale, Sophie H.
• Journal of publication: Acta Crystallographica Section C
• Year of publication: 2007
• Journal volume: 63
• Journal issue: 1
• Pages of publication: m7 - m9
• a: 17.3748 ± 0.0005 Å
• b: 14.3919 ± 0.0004 Å
• c: 18.3124 ± 0.0005 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 4579.1 ± 0.2 ų
• Cell temperature: 150 ± 2 K
• Ambient diffraction temperature: 150 ± 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: 0.0267
• Residual factor for significantly intense reflections: 0.0201
• Weighted residual factors for significantly intense reflections: 0.0499
• Weighted residual factors for all reflections included in the refinement: 0.0557
• Goodness-of-fit parameter for all reflections included in the refinement: 1.098
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes