Information card for entry 4115878

Structure parameters

• Formula: C45 H56 Cl2 N8 Ni2 O11
• Calculated formula: C45 H56 Cl2 N8 Ni2 O11
• Title of publication: Synthesis, Structures, and Properties of Bis(μ-oxo)nickel(III) and Bis(μ-superoxo)nickel(II) Complexes: An Unusual Conversion of a NiIII2(μ-O)2 Core into a NiII2(μ-OO)2 Core by H2O2 and Oxygenation of Ligand
• Authors of publication: Kazushi Shiren; Seiji Ogo; Shuhei Fujinami; Hideki Hayashi; Masatatsu Suzuki; Akira Uehara; Yoshihito Watanabe; Yoshihiko Moro-oka
• Journal of publication: Journal of the American Chemical Society
• Year of publication: 2000
• Journal volume: 122
• Pages of publication: 254 - 262
• a: 12.916 ± 0.003 Å
• b: 17.394 ± 0.003 Å
• c: 11.7 ± 0.003 Å
• α: 107.22 ± 0.02°
• β: 108.63 ± 0.02°
• γ: 84.53 ± 0.02°
• Cell volume: 2379.2 ± 1 ų
• Cell temperature: 157 K
• Ambient diffraction temperature: 157 K
• Number of distinct elements: 6
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for significantly intense reflections: 0.0557
• Weighted residual factors for significantly intense reflections: 0.0955
• Goodness-of-fit parameter for significantly intense reflections: 1.654
• Diffraction radiation wavelength: 0.7107 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No