Information card for entry 2213943

Structure parameters

• Chemical name: Diaquabis(2-benzoylpyridine-κ^2^N,O)cobalt(II) bis(perchlorate)
• Formula: C24 H22 Cl2 Co N2 O12
• Calculated formula: C24 H22 Cl2 Co N2 O12
• SMILES: c12C(c3ccccc3)=[O][Co]3([n]2cccc1)([OH2])([n]1c(C(c2ccccc2)=[O]3)cccc1)[OH2].[O-]Cl(=O)(=O)=O.[O-]Cl(=O)(=O)=O
• Title of publication: Diaquabis(2-benzoylpyridine-κ^2^<i>N</i>,<i>O</i>)cobalt(II) bis(perchlorate)
• Authors of publication: Li, Ya-Min; Zhao, Xiao-Wei
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2007
• Journal volume: 63
• Journal issue: 6
• Pages of publication: m1589 - m1590
• a: 9.3598 ± 0.0005 Å
• b: 11.7387 ± 0.0006 Å
• c: 12.8062 ± 0.0007 Å
• α: 90°
• β: 90.923 ± 0.002°
• γ: 90°
• Cell volume: 1406.86 ± 0.13 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 6
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/n 1
• Hall space group symbol: -P 2yn
• Residual factor for significantly intense reflections: 0.0667
• Weighted residual factors for significantly intense reflections: 0.146
• Weighted residual factors for all reflections included in the refinement: 0.1604
• Goodness-of-fit parameter for all reflections included in the refinement: 1.16
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes