Information card for entry 2023541

Structure parameters

• Chemical name: Bis(benzothiazole-2-thiolato-κ<i>S</i>)(1,10-phenanthroline-κ^2^<i>N</i>,<i>N</i>')zinc(II)
• Formula: C26 H16 N4 S4 Zn
• Calculated formula: C26 H16 N4 S4 Zn
• Title of publication: Synthesis and crystal structure analysis of bis(benzothiazole-2-thiolato-κS)(1,10-phenanthroline-κ2 N,N′)zinc(II)
• Authors of publication: Abdullayeva, Gulchekhra; Torambetov, Batirbay; Kadirova, Shakhnoza; Daminova, Shahlo
• Journal of publication: Acta Crystallographica Section E Crystallographic Communications
• Year of publication: 2025
• Journal volume: 81
• Journal issue: 7
• a: 19.9559 ± 0.0009 Å
• b: 9.8232 ± 0.0005 Å
• c: 14.0704 ± 0.0007 Å
• α: 90°
• β: 118.642 ± 0.001°
• γ: 90°
• Cell volume: 2420.7 ± 0.2 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 K
• Number of distinct elements: 5
• Space group number: 15
• Hermann-Mauguin space group symbol: C 1 2/c 1
• Hall space group symbol: -C 2yc
• Residual factor for all reflections: 0.0482
• Residual factor for significantly intense reflections: 0.0361
• Weighted residual factors for significantly intense reflections: 0.0858
• Weighted residual factors for all reflections included in the refinement: 0.0932
• Goodness-of-fit parameter for all reflections included in the refinement: 1.079
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No