Information card for entry 4341379

Structure parameters

• Formula: C43.18 H57.95 Br2 F6 N6 Ni2 O0.79 P
• Calculated formula: C43.18 H57.95 Br2 F6 N6 Ni2 O0.795 P
• Title of publication: Dinuclear nickel complexes in five States of oxidation using a redox-active ligand.
• Authors of publication: Zhou, You-Yun; Hartline, Douglas R.; Steiman, Talia J.; Fanwick, Phillip E.; Uyeda, Christopher
• Journal of publication: Inorganic chemistry
• Year of publication: 2014
• Journal volume: 53
• Journal issue: 21
• Pages of publication: 11770 - 11777
• a: 10.6267 ± 0.0003 Å
• b: 31.1603 ± 0.0009 Å
• c: 15.8194 ± 0.0005 Å
• α: 90°
• β: 100.166 ± 0.003°
• γ: 90°
• Cell volume: 5156.1 ± 0.3 ų
• Cell temperature: 200 ± 2 K
• Ambient diffraction temperature: 200 ± 2 K
• Number of distinct elements: 8
• 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: 0.0634
• Residual factor for significantly intense reflections: 0.0544
• Weighted residual factors for significantly intense reflections: 0.159
• Weighted residual factors for all reflections included in the refinement: 0.1751
• Goodness-of-fit parameter for all reflections included in the refinement: 1.068
• Diffraction radiation wavelength: 1.54178 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No