Information card for entry 2215266

Structure parameters

• Chemical name: Dichloridobis(2-methyl-1,3-benzothiazole-κ<i>N</i>)zinc(II)
• Formula: C16 H14 Cl2 N2 S2 Zn
• Calculated formula: C16 H14 Cl2 N2 S2 Zn
• SMILES: [Zn](Cl)(Cl)([n]1c2ccccc2sc1C)[n]1c2ccccc2sc1C
• Title of publication: Dichloridobis(2-methyl-1,3-benzothiazole-κ<i>N</i>)zinc(II)
• Authors of publication: Roh, Soo-Gyun; Jeong, Jong Hwa
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2007
• Journal volume: 63
• Journal issue: 9
• Pages of publication: m2334 - m2334
• a: 8.4063 ± 0.0004 Å
• b: 9.0758 ± 0.0007 Å
• c: 12.8451 ± 0.0006 Å
• α: 72.82 ± 0.004°
• β: 78.778 ± 0.004°
• γ: 69.938 ± 0.005°
• Cell volume: 874.7 ± 0.09 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: 0.0324
• Residual factor for significantly intense reflections: 0.0257
• Weighted residual factors for significantly intense reflections: 0.0742
• Weighted residual factors for all reflections included in the refinement: 0.0759
• Goodness-of-fit parameter for all reflections included in the refinement: 1.067
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes