Information card for entry 8102476

Structure parameters

• Formula: C31 H27 Cl N8 O6 Zn
• Calculated formula: C31 H27 Cl N8 O6 Zn
• Title of publication: Crystal structure of [tris(2-benzimidazolymethyl)amine-N,N',N'',N''']-(2-aminobenzoato-O)zinc(II) perchlorate, [Zn(C24H21N7)(C7H6NO2)]ClO4
• Authors of publication: Feng-Mei Nie; Min Li; Wei Liu; Guo-Xing Li; Tao Fang
• Journal of publication: Zeitschrift für Kristallographie - New Crystal Structures
• Year of publication: 2009
• Journal volume: 224
• Journal issue: 3
• Pages of publication: 446
• a: 10.0687 ± 0.0004 Å
• b: 12.2891 ± 0.0005 Å
• c: 14.0851 ± 0.0006 Å
• α: 99.625 ± 0.002°
• β: 99.515 ± 0.002°
• γ: 110.751 ± 0.002°
• Cell volume: 1558.44 ± 0.12 ų
• Cell temperature: 296 ± 2 K
• Ambient diffraction temperature: 296 ± 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 all reflections: 0.0545
• Residual factor for significantly intense reflections: 0.0431
• Weighted residual factors for significantly intense reflections: 0.1196
• Weighted residual factors for all reflections included in the refinement: 0.1326
• Goodness-of-fit parameter for all reflections included in the refinement: 1.058
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No