Information card for entry 4307429

Structure parameters

• Formula: C31 H41.5 Ce N5 Ni2 O22
• Calculated formula: C31 H41.5 Ce N5 Ni2 O22
• Title of publication: Series of Trinuclear NiIILnIIINiII Complexes Derived from 2,6-Di(acetoacetyl)pyridine: Synthesis, Structure, and Magnetism
• Authors of publication: Takuya Shiga; Nobuhiro Ito; Akiko Hidaka; Hisashi Ōkawa; Susumu Kitagawa; Masaaki Ohba
• Journal of publication: Inorganic Chemistry
• Year of publication: 2007
• Journal volume: 46
• Pages of publication: 3492 - 3501
• a: 7.8217 ± 0.0002 Å
• b: 9.4165 ± 0.0003 Å
• c: 14.5053 ± 0.0005 Å
• α: 92.707 ± 0.002°
• β: 104.827 ± 0.002°
• γ: 91.333 ± 0.001°
• Cell volume: 1030.94 ± 0.06 ų
• Cell temperature: 183.2 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: 0.0286
• Weighted residual factors for all reflections included in the refinement: 0.0863
• Goodness-of-fit parameter for all reflections included in the refinement: 0.997
• Diffraction radiation wavelength: 0.7107 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No