Information card for entry 7001603

Structure parameters

• Formula: C14 H16 F3 N3 O3 Pd S
• Calculated formula: C14 H16 F3 N3 O3 Pd S
• Title of publication: A dipalladium complex with a single hydroxo bridge and its methylpalladium precursor
• Authors of publication: Cao, Lingyun; Jennings, Michael C.; Puddephatt, Richard J.
• Journal of publication: Dalton Transactions
• Year of publication: 2009
• Journal issue: 26
• Pages of publication: 5171 - 5176
• a: 8.9817 ± 0.0007 Å
• b: 6.9983 ± 0.0004 Å
• c: 14.1109 ± 0.001 Å
• α: 90°
• β: 107.961 ± 0.003°
• γ: 90°
• Cell volume: 843.74 ± 0.1 ų
• Cell temperature: 150 ± 2 K
• Ambient diffraction temperature: 150 ± 2 K
• Number of distinct elements: 7
• Space group number: 11
• Hermann-Mauguin space group symbol: P 1 21/m 1
• Hall space group symbol: -P 2yb
• Residual factor for all reflections: 0.0473
• Residual factor for significantly intense reflections: 0.0431
• Weighted residual factors for significantly intense reflections: 0.1233
• Weighted residual factors for all reflections included in the refinement: 0.126
• Goodness-of-fit parameter for all reflections included in the refinement: 1.219
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No