Information card for entry 2216632

Structure parameters

• Chemical name: Bis(pyridine-2-methanol-κ^2^<i>N</i>,<i>O</i>]bis(thiocyanato-κN)cobalt(II)
• Formula: C14 H14 Co N4 O2 S2
• Calculated formula: C14 H14 Co N4 O2 S2
• SMILES: C1c2cccc[n]2[Co]2(N=C=S)([OH]1)([n]1c(C[OH]2)cccc1)N=C=S
• Title of publication: Bis(pyridine-2-methanol-κ^2^<i>N</i>,<i>O</i>]bis(thiocyanato-κ<i>N</i>)cobalt(II)
• Authors of publication: Yu-Peng Pan; Da-Cheng Li; Da-Qi Wang
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2007
• Journal volume: 63
• Journal issue: 12
• Pages of publication: m3034 - m3034
• a: 11.371 ± 0.01 Å
• b: 8.255 ± 0.008 Å
• c: 17.779 ± 0.016 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 1669 ± 3 ų
• Cell temperature: 298 ± 2 K
• Ambient diffraction temperature: 298 ± 2 K
• Number of distinct elements: 6
• Space group number: 60
• Hermann-Mauguin space group symbol: P b c n
• Hall space group symbol: -P 2n 2ab
• Residual factor for all reflections: 0.0773
• Residual factor for significantly intense reflections: 0.0547
• Weighted residual factors for significantly intense reflections: 0.1477
• Weighted residual factors for all reflections included in the refinement: 0.1697
• Goodness-of-fit parameter for all reflections included in the refinement: 1.002
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes