Information card for entry 2223208

Structure parameters

• Chemical name: Bis(2-aminobenzothiazole-κ<i>N</i>^1^)bis(thiocyanato-κ<i>N</i>)zinc(II)
• Formula: C16 H12 N6 S4 Zn
• Calculated formula: C16 H12 N6 S4 Zn
• SMILES: [Zn](N=C=S)(N=C=S)([n]1c(sc2c1cccc2)N)[n]1c(sc2c1cccc2)N
• Title of publication: Bis(2-aminobenzothiazole-κ<i>N</i>^1^)bis(thiocyanato-κ<i>N</i>)zinc(II)
• Authors of publication: Suh, Seung Wook; Kim, Chong-Hyeak; Kim, Inn Hoe
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2009
• Journal volume: 65
• Journal issue: 9
• Pages of publication: m1054
• a: 8.4379 ± 0.0001 Å
• b: 9.49 ± 0.0001 Å
• c: 13.3037 ± 0.0002 Å
• α: 97.735 ± 0.001°
• β: 107.302 ± 0.001°
• γ: 94.232 ± 0.001°
• Cell volume: 1000.52 ± 0.02 ų
• Cell temperature: 296 ± 2 K
• Ambient diffraction temperature: 296 ± 2 K
• Number of distinct elements: 5
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.035
• Residual factor for significantly intense reflections: 0.03
• Weighted residual factors for significantly intense reflections: 0.075
• Weighted residual factors for all reflections included in the refinement: 0.079
• Goodness-of-fit parameter for all reflections included in the refinement: 1.05
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes