Information card for entry 2229347

Structure parameters

• Chemical name: Acetonitrile[2-({bis[2,4,6- tris(trifluoromethyl)phenyl]phosphanyloxy}methyl)pyridine]methylpalladium(II) hexafluoridoantimonate dichloromethane hemisolvate
• Formula: C27.5 H17 Cl F24 N2 O P Pd Sb
• Calculated formula: C27.5 H17 Cl F24 N2 O P Pd Sb
• Title of publication: Acetonitrile[2-({bis[2,4,6-tris(trifluoridomethyl)phenyl]phosphanyloxy}methyl)pyridine]methylpalladium(II) hexafluoroantimonate dichloromethane hemisolvate
• Authors of publication: Li, Liuzhong; White, Peter S.; Hao, Aiyou
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2011
• Journal volume: 67
• Journal issue: 3
• Pages of publication: m366
• a: 8.6993 ± 0.0004 Å
• b: 11.812 ± 0.0005 Å
• c: 18.1494 ± 0.0008 Å
• α: 78.557 ± 0.002°
• β: 82.007 ± 0.002°
• γ: 79.526 ± 0.002°
• Cell volume: 1787.14 ± 0.14 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 9
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0392
• Residual factor for significantly intense reflections: 0.0356
• Weighted residual factors for significantly intense reflections: 0.0905
• Weighted residual factors for all reflections included in the refinement: 0.093
• Goodness-of-fit parameter for all reflections included in the refinement: 1.048
• Diffraction radiation wavelength: 1.54178 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes