Information card for entry 1100983

Structure parameters

• Formula: C43.33 H51.33 B2.67 Cl2.67 F16.67 N2 O2 Pd
• Calculated formula: C43.3333 H51.3333 B2.66667 Cl2.66667 F16.6667 N2 O2 Pd
• Title of publication: Structural Characterization of Four Members of the Electron-Transfer Series [PdII(L)2)2]n (L = o-Iminophenolate Derivative; n= 2-, 1-, 0, 1+, 2+). Ligand Mixed Valency in the Monocation and Monoanion with S=1/2 Ground States
• Authors of publication: Swarnalatha Kokatam; Thomas Weyhermüller; Eberhard Bothe; Phalguni Chaudhuri; Karl Wieghardt
• Journal of publication: Inorganic Chemistry
• Year of publication: 2005
• Journal volume: 44
• Pages of publication: 3709 - 3717
• a: 13.5833 ± 0.0005 Å
• b: 16.8101 ± 0.0007 Å
• c: 18.3743 ± 0.0007 Å
• α: 78.548 ± 0.005°
• β: 72.946 ± 0.005°
• γ: 78.209 ± 0.005°
• Cell volume: 3883.1 ± 0.3 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 8
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0675
• Residual factor for significantly intense reflections: 0.0568
• Weighted residual factors for significantly intense reflections: 0.1331
• Weighted residual factors for all reflections included in the refinement: 0.1401
• Goodness-of-fit parameter for all reflections included in the refinement: 1.128
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No