Information card for entry 4315746

Structure parameters

• Formula: C24 H48 B2 F8 N6 Ni2 S2
• Calculated formula: C24 H48 B2 F8 N6 Ni2 S2
• Title of publication: Orientation and Stereodynamic Paths of Planar Monodentate Ligands in Square Planar Nickel N2S Complexes
• Authors of publication: Roxanne M. Jenkins; Michael L. Singleton; Lauren A. Leamer; Joseph H. Reibenspies; Marcetta Y. Darensbourg
• Journal of publication: Inorganic Chemistry
• Year of publication: 2010
• Journal volume: 49
• Pages of publication: 5503 - 5514
• a: 9.967 ± 0.003 Å
• b: 11.316 ± 0.003 Å
• c: 16.49 ± 0.005 Å
• α: 81.848 ± 0.005°
• β: 76.059 ± 0.005°
• γ: 68.849 ± 0.005°
• Cell volume: 1680.4 ± 0.8 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 7
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.1044
• Residual factor for significantly intense reflections: 0.0759
• Weighted residual factors for significantly intense reflections: 0.1761
• Weighted residual factors for all reflections included in the refinement: 0.1921
• Goodness-of-fit parameter for all reflections included in the refinement: 1.041
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No