Information card for entry 2202868

Structure parameters

• Common name: 1,4-Bis(thiazol-2-ylsulfanyl)butane
• Chemical name: trans-Dichlorobis{2-[2-(4-methoxylphenyl)ethenyl]-5-methyl-1,3-benzoxazole- κN}cobalt(II)
• Formula: C34 H30 Cl2 Co N2 O4
• Calculated formula: C34 H30 Cl2 Co N2 O4
• SMILES: c12cc(ccc1oc(/C=C/c1ccc(OC)cc1)[n]2[Co](Cl)([n]1c2cc(ccc2oc1/C=C/c1ccc(OC)cc1)C)Cl)C
• Title of publication: <i>trans</i>-Dichlorobis{2-[2-(4-methoxyphenyl)ethenyl]-5-methyl-1,3-benzoxazole-κ<i>N</i>}cobalt(II)
• Authors of publication: Jia, Zheng-shan; Liu, Hui-Min; Zheng, Yan; Zhang, Wen-Qin
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2003
• Journal volume: 59
• Journal issue: 11
• Pages of publication: m1002 - m1003
• a: 15.172 ± 0.004 Å
• b: 12.218 ± 0.003 Å
• c: 18.153 ± 0.005 Å
• α: 90°
• β: 106.603 ± 0.005°
• γ: 90°
• Cell volume: 3224.8 ± 1.5 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: 0.105
• Residual factor for significantly intense reflections: 0.05
• Weighted residual factors for all reflections included in the refinement: 0.1211
• Goodness-of-fit parameter for all reflections included in the refinement: 1.011
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes