Information card for entry 2008167

Structure parameters

• Chemical name: cis-Bis(2-aminobenzothiazole-N)-bis(formato-O,O')copper(II)
• Formula: C16 H14 Cu N4 O4 S2
• Calculated formula: C16 H14 Cu N4 O4 S2
• SMILES: C(=[O]1)O[Cu]12([n]1c(N)sc3ccccc13)([n]1c(N)sc3ccccc13)OC=[O]2
• Title of publication: <i>cis</i>-Bis(2-amino-1,3-benzothiazole-<i>N</i>^3^)bis(formato-<i>O</i>,<i>O</i>')copper(II)
• Authors of publication: Sieroń, Lesław; Bukowska-Strzyżewska, Maria
• Journal of publication: Acta Crystallographica Section C
• Year of publication: 1999
• Journal volume: 55
• Journal issue: 2
• Pages of publication: 167 - 169
• a: 18.3481 ± 0.0016 Å
• b: 8.3075 ± 0.0007 Å
• c: 13.2995 ± 0.0009 Å
• α: 90°
• β: 113.96 ± 0.006°
• γ: 90°
• Cell volume: 1852.5 ± 0.3 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 6
• 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: 0.0387
• Residual factor for significantly intense reflections: 0.0325
• Weighted residual factors for all reflections included in the refinement: 0.0801
• Goodness-of-fit parameter for all reflections included in the refinement: 1.142
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No