Information card for entry 2023336

Structure parameters

• Chemical name: <i>catena</i>-Poly[[bis(4-methylpyridine-κ<i>N</i>)cobalt(II)]-di-μ-thiocyanato-κ^2^<i>N</i>:<i>S</i>;κ^2^<i>S</i>:<i>N</i>]
• Formula: C14 H14 Co N4 S2
• Calculated formula: C14 H14 Co N4 S2
• Title of publication: Synthesis, crystal structure and properties of catena-poly[[bis(4-methylpyridine-κN)cobalt(II)]-di-μ-thiocyanato-κ2 N:S;κ2 S:N], which shows a rare coordination geometry
• Authors of publication: Näther, Christian; Boeckmann, Jan
• Journal of publication: Acta Crystallographica Section E Crystallographic Communications
• Year of publication: 2025
• Journal volume: 81
• Journal issue: 1
• a: 20.1106 ± 0.0012 Å
• b: 9.2112 ± 0.0004 Å
• c: 19.2309 ± 0.0012 Å
• α: 90°
• β: 116.353 ± 0.006°
• γ: 90°
• Cell volume: 3192.2 ± 0.4 ų
• Cell temperature: 220 ± 2 K
• Ambient diffraction temperature: 220.15 K
• Number of distinct elements: 5
• 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: 0.0427
• Residual factor for significantly intense reflections: 0.0346
• Weighted residual factors for significantly intense reflections: 0.0902
• Weighted residual factors for all reflections included in the refinement: 0.0948
• Goodness-of-fit parameter for all reflections included in the refinement: 1.041
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No