Information card for entry 8102481

Structure parameters

• Chemical name: [tris(2-benzimidazolylmethyl)amine-N, N^'^, N^''^, N^'''^] (methanol-O)(3,5-dinitrobenzoate-O)Nickel(II) nitrate-methanol, [Ni(C~24~H~21~N~7~)(C~7~H~3~O~6~N~2~)(CH~3~OH)]~2~(NO~3~)~2~?(CH~3~OH)~3~
• Formula: C33.5 H34 N10 Ni O11.5
• Calculated formula: C33.5 H34 N10 Ni O11.5
• Title of publication: Crystal structure of [tris(2-benzimidazolylmethyl)amine-N,N',N'',N''']-(methanol-O)-(3,5-dinitrobenzoato-O)nickel(II) nitrate — methanol (1:3), [Ni(C24H21N7)(C7H3O6N2)(CH3OH)]2(NO3)2 · 3CH3OH
• Authors of publication: Feng-Mei Nie; Jing Chen; Fei Lu
• Journal of publication: Zeitschrift für Kristallographie - New Crystal Structures
• Year of publication: 2010
• Journal volume: 225
• Journal issue: 1
• Pages of publication: 27
• a: 20.157 ± 0.004 Å
• b: 16.337 ± 0.003 Å
• c: 23.218 ± 0.005 Å
• α: 90°
• β: 104.72 ± 0.03°
• γ: 90°
• Cell volume: 7395 ± 3 ų
• Cell temperature: 113 ± 2 K
• Ambient diffraction temperature: 113 ± 2 K
• Number of distinct elements: 5
• 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: 0.1221
• Residual factor for significantly intense reflections: 0.1068
• Weighted residual factors for significantly intense reflections: 0.2572
• Weighted residual factors for all reflections included in the refinement: 0.2676
• 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: No
• Has Fobs: No