Information card for entry 8106030

Structure parameters

• Formula: C40 H34 N4 O6 S Zn
• Calculated formula: C40 H34 N4 O6 S Zn
• Title of publication: Crystal structure of poly[(μ2-1,4-bis((2-ethyl-1H-benzo[d]imidazol-1-yl)methyl)benzene-κ2 N:N′)-(μ2-4,4′-sulfonyldibenzoato-κ2 O:O′)zinc(II)], C40H34N4O6SZn
• Authors of publication: Xu, Chunying; Li, Jili; Li, Minghui; Cui, Lu
• Journal of publication: Zeitschrift für Kristallographie - New Crystal Structures
• Year of publication: 2018
• Journal volume: 233
• Journal issue: 1
• Pages of publication: 17 - 19
• a: 11.157 ± 0.002 Å
• b: 11.867 ± 0.002 Å
• c: 14.141 ± 0.003 Å
• α: 75.3 ± 0.03°
• β: 86.09 ± 0.03°
• γ: 84.91 ± 0.03°
• Cell volume: 1801.8 ± 0.6 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 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: 0.049
• Residual factor for significantly intense reflections: 0.0419
• Weighted residual factors for significantly intense reflections: 0.1019
• Weighted residual factors for all reflections included in the refinement: 0.1063
• Goodness-of-fit parameter for all reflections included in the refinement: 1.138
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No