Information card for entry 2209795

Structure parameters

• Formula: C29 H25 Cl N2 O P2 Pd
• Calculated formula: C29 H25 Cl N2 O P2 Pd
• SMILES: [Pd]1([P](Nc2[n]1cccc2)(c1ccccc1)c1ccccc1)(P(=O)(c1ccccc1)c1ccccc1)Cl
• Title of publication: Chloro[<i>N</i>-(diphenylphosphino)pyridin-2-amine-κ^2^<i>N</i>^1^,<i>P</i>](diphenylphosphoryl)palladium(II)
• Authors of publication: Li, Peng; Li, Qing-Shan; Xu, Feng-Bo; Song, Hai-Bin; Zhang, Zheng-Zhi
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2006
• Journal volume: 62
• Journal issue: 8
• Pages of publication: m1825 - m1826
• a: 13.226 ± 0.002 Å
• b: 13.594 ± 0.002 Å
• c: 30.205 ± 0.005 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 5430.7 ± 1.5 ų
• Cell temperature: 294 ± 2 K
• Ambient diffraction temperature: 294 ± 2 K
• Number of distinct elements: 7
• 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: 0.142
• Residual factor for significantly intense reflections: 0.057
• Weighted residual factors for significantly intense reflections: 0.0949
• Weighted residual factors for all reflections included in the refinement: 0.1234
• Goodness-of-fit parameter for all reflections included in the refinement: 1.123
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes