Information card for entry 4314868

Structure parameters

• Formula: C28 H20 F6 N2 O4 Pd2
• Calculated formula: C28 H20 F6 N2 O4 Pd2
• Title of publication: Electronic Structures of PdII Dimers
• Authors of publication: John E. Bercaw; Alec C. Durrell; Harry B. Gray; Jennifer C. Green; Nilay Hazari; Jay A. Labinger; Jay R. Winkler
• Journal of publication: Inorganic Chemistry
• Year of publication: 2010
• Journal volume: 49
• Pages of publication: 1801 - 1810
• a: 20.8769 ± 0.0012 Å
• b: 17.3672 ± 0.0009 Å
• c: 25.166 ± 0.0013 Å
• α: 90°
• β: 112.114 ± 0.002°
• γ: 90°
• Cell volume: 8453.3 ± 0.8 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 6
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/c 1
• Hall space group symbol: -P 2ybc
• Residual factor for all reflections: 0.1474
• Residual factor for significantly intense reflections: 0.1048
• Weighted residual factors for significantly intense reflections: 0.1464
• Weighted residual factors for all reflections included in the refinement: 0.1487
• Goodness-of-fit parameter for all reflections included in the refinement: 4.012
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No