Information card for entry 2214916

Structure parameters

• Chemical name: Bis(μ-pyridine-2,3-dicarboxylato)bis[aqua(2,2'-diamino-4,4'-bi-1,3-\ thiazole)cobalt(II)] decahydrate
• Formula: C26 H42 Co2 N10 O20 S4
• Calculated formula: C26 H42 Co2 N10 O20 S4
• SMILES: c12csc([n]2[Co]23([n]4c1csc4N)([OH2])[n]1c(c(ccc1)C(=O)O[Co]14([n]5c(csc5N)c5csc([n]15)N)([OH2])[n]1c(c(ccc1)C(=O)O3)C(=O)O4)C(=O)O2)N.O.O.O.O.O.O.O.O.O.O
• Title of publication: Bis(μ-pyridine-2,3-dicarboxylato)bis[aqua(2,2'-diamino-4,4'-bi-1,3-thiazole)cobalt(II)] decahydrate
• Authors of publication: Yuan-Yuan Lin; Guang-Hua Chen; Yan-Ping Yu; Bing-Xin Liu
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2007
• Journal volume: 63
• Journal issue: 8
• Pages of publication: m2178 - m2179
• a: 8.1415 ± 0.0012 Å
• b: 11.2685 ± 0.0017 Å
• c: 12.0084 ± 0.0018 Å
• α: 74.269 ± 0.002°
• β: 82.864 ± 0.002°
• γ: 87.713 ± 0.002°
• Cell volume: 1052.2 ± 0.3 ų
• Cell temperature: 295 ± 2 K
• Ambient diffraction temperature: 295 ± 2 K
• Number of distinct elements: 6
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.055
• Residual factor for significantly intense reflections: 0.041
• Weighted residual factors for significantly intense reflections: 0.086
• Weighted residual factors for all reflections included in the refinement: 0.094
• Goodness-of-fit parameter for all reflections included in the refinement: 1.062
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes