Information card for entry 2217571

Structure parameters

• Chemical name: Bis(pyridine-κN)bis[4,4,4-trifluoro-1-(4-fluorophenyl)butane-1,3-dionato-\ κ^2^O,O']cobalt(II)
• Formula: C30 H20 Co F8 N2 O4
• Calculated formula: C30 H20 Co F8 N2 O4
• SMILES: [Co]12([n]3ccccc3)([n]3ccccc3)(OC(=CC(c3ccc(cc3)F)=[O]1)C(F)(F)F)OC(=CC(c1ccc(cc1)F)=[O]2)C(F)(F)F
• Title of publication: Bis(pyridine-κ<i>N</i>)bis[4,4,4-trifluoro-1-(4-fluorophenyl)butane-1,3-dionato-κ^2^<i>O</i>,<i>O</i>']cobalt(II)
• Authors of publication: Ling Fan; Dunjia Wang; Lihong Peng; Xiaocui Ke
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2008
• Journal volume: 64
• Journal issue: 2
• Pages of publication: m347 - m347
• a: 8.5181 ± 0.0006 Å
• b: 17.0379 ± 0.0013 Å
• c: 10.015 ± 0.0007 Å
• α: 90°
• β: 90.374 ± 0.002°
• γ: 90°
• Cell volume: 1453.45 ± 0.18 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/c 1
• Hall space group symbol: -P 2ybc
• Residual factor for all reflections: 0.1029
• Residual factor for significantly intense reflections: 0.0593
• Weighted residual factors for significantly intense reflections: 0.1229
• Weighted residual factors for all reflections included in the refinement: 0.1383
• Goodness-of-fit parameter for all reflections included in the refinement: 1.095
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes