Information card for entry 2203688

Structure parameters

• Chemical name: Tetrakis(μ-acetato-O:O')bis[(2-benzylidene-6,7-dihydro-5H-thiazolo[3,2-a] pyrimidin-3-one)cobalt(II)]
• Formula: C34 H36 Co2 N4 O10 S2
• Calculated formula: C34 H36 Co2 N4 O10 S2
• SMILES: C1CCN2C(=[N]1[Co]1345[O]=C(O[Co]5([N]5CCCN6C=5SC(=C\c5ccccc5)/C6=O)([O]=C(O1)C)(OC(=[O]4)C)[O]=C(O3)C)C)S/C(=C\c1ccccc1)C2=O
• Title of publication: Tetra-μ-acetato-κ^8^<i>O</i>:<i>O</i>'-bis[(2-benzylidene-6,7-dihydro-5<i>H</i>-thiazolo[3,2-<i>a</i>]pyrimidin-3-one-κ<i>N</i>)cobalt(II)]
• Authors of publication: Wang, Dong-Hua; Li, Xun; Liu, Xin-Gang
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2004
• Journal volume: 60
• Journal issue: 5
• Pages of publication: m703 - m704
• a: 22.268 ± 0.006 Å
• b: 12.924 ± 0.004 Å
• c: 14.674 ± 0.004 Å
• α: 90°
• β: 123.375 ± 0.004°
• γ: 90°
• Cell volume: 3526.6 ± 1.7 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: 0.052
• Residual factor for significantly intense reflections: 0.033
• Weighted residual factors for all reflections included in the refinement: 0.194
• Goodness-of-fit parameter for all reflections included in the refinement: 1.04
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes