Information card for entry 2013173

Structure parameters

• Common name: bis(7-aminobenzothiazole)zinc(II) chloride
• Chemical name: Bis(7-amino-1,3-benzothiazole-κN^3^)dichlorozinc(II)
• Formula: C14 H12 Cl2 N4 S2 Zn
• Calculated formula: C14 H12 Cl2 N4 S2 Zn
• SMILES: [Zn](Cl)(Cl)([n]1csc2c1cccc2N)[n]1c2cccc(N)c2sc1
• Title of publication: Bis(7-amino-1,3-benzothiazole-κ<i>N</i>^3^)dichlorozinc(II)
• Authors of publication: Popović, Zora; Pavlović, Gordana; Soldin, Željka; Tralić-Kulenović, Vesna; Racané, Livio
• Journal of publication: Acta Crystallographica Section C
• Year of publication: 2003
• Journal volume: 59
• Journal issue: 1
• Pages of publication: m4 - m6
• a: 10.562 ± 0.0007 Å
• b: 11.4321 ± 0.0018 Å
• c: 13.7109 ± 0.0013 Å
• α: 90°
• β: 91.587 ± 0.009°
• γ: 90°
• Cell volume: 1654.9 ± 0.3 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 6
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/c 1
• Hall space group symbol: -P 2ybc
• Residual factor for all reflections: 0.069
• Residual factor for significantly intense reflections: 0.032
• Weighted residual factors for significantly intense reflections: 0.066
• Weighted residual factors for all reflections included in the refinement: 0.075
• Goodness-of-fit parameter for all reflections included in the refinement: 1.016
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes