Information card for entry 4325985

Structure parameters

• Formula: C64.7 H59 B2 Cl1.4 F24 N O2.3 P2 Pd
• Calculated formula: C64.7 H59 B2 Cl1.4 F24 N O2.3 P2 Pd
• Title of publication: Net Heterolytic Cleavage of B-H and B-B Bonds Across the N-Pd Bond in a Cationic (PNP)Pd Fragment
• Authors of publication: Yanjun Zhu; Chun-Hsing Chen; Claudia M. Fafard; Bruce M. Foxman; Oleg V. Ozerov
• Journal of publication: Inorganic Chemistry
• Year of publication: 2011
• Journal volume: 50
• Pages of publication: 7980 - 7987
• a: 17.166 ± 0.0008 Å
• b: 18.3171 ± 0.0009 Å
• c: 22.9978 ± 0.0011 Å
• α: 90°
• β: 107.121 ± 0.003°
• γ: 90°
• Cell volume: 6910.8 ± 0.6 ų
• Cell temperature: 120 K
• Ambient diffraction temperature: 120 K
• Number of distinct elements: 9
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/n 1
• Hall space group symbol: -P 2yn
• Residual factor for all reflections: 0.0775
• Residual factor for significantly intense reflections: 0.0457
• Weighted residual factors for all reflections: 0.1298
• Weighted residual factors for significantly intense reflections: 0.1105
• Weighted residual factors for all reflections included in the refinement: 0.1298
• Goodness-of-fit parameter for all reflections included in the refinement: 0.9765
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No