Information card for entry 7050037

Structure parameters

• Formula: C41.24 H39.47 Br2 Cl2.47 N Ni O P2
• Calculated formula: C41.236 H39.4718 Br2 Cl2.472 N Ni O P2
• Title of publication: New group 10 complexes of the bulky iminophosphine ligands [Ph2PCH2C(Ph)?N(2,6-R2C6H3)], where R = Me, iPr
• Authors of publication: Sofia I. Pascu; Karl S. Coleman; A. R. Cowley; Malcolm L. H. Green; Nicholas H. Rees
• Journal of publication: New Journal of Chemistry
• Year of publication: 2005
• Journal volume: 29
• Journal issue: 2
• Pages of publication: 385
• a: 13.535 ± 0.0006 Å
• b: 23.464 ± 0.002 Å
• c: 27.85 ± 0.003 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 8844.7 ± 1.3 ų
• Cell temperature: 150 K
• Ambient diffraction temperature: 150 K
• Number of distinct elements: 8
• Space group number: 61
• Hermann-Mauguin space group symbol: P c a b
• Hall space group symbol: -P 2bc 2ac
• Residual factor for all reflections: 0.131
• Residual factor for significantly intense reflections: 0.0581
• Weighted residual factors for all reflections: 0.0962
• Weighted residual factors for significantly intense reflections: 0.0658
• Weighted residual factors for all reflections included in the refinement: 0.0658
• Goodness-of-fit parameter for all reflections included in the refinement: 1.2474
• Diffraction radiation wavelength: 0.71069 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No