Information card for entry 7115751

Structure parameters

• Common name: Co(quinoline)2I2
• Formula: C18 H14 Co I2 N2
• Calculated formula: C18 H14 Co I2 N2
• SMILES: I[Co](I)([n]1cccc2c1cccc2)[n]1c2c(cccc2)ccc1
• Title of publication: Ligands effects on the magnetic anisotropy of tetrahedral cobalt complexes
• Authors of publication: Mohamed R. Saber; Kim R. Dunbar
• Journal of publication: Chem.Commun.
• Year of publication: 2014
• Journal volume: 50
• Pages of publication: 12266
• a: 7.9139 ± 0.0016 Å
• b: 15.284 ± 0.003 Å
• c: 14.611 ± 0.003 Å
• α: 90°
• β: 90.99 ± 0.03°
• γ: 90°
• Cell volume: 1767 ± 0.6 ų
• Cell temperature: 110 ± 2 K
• Ambient diffraction temperature: 110 ± 2 K
• Number of distinct elements: 5
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/n 1
• Hall space group symbol: -P 2yn
• Residual factor for all reflections: 0.0327
• Residual factor for significantly intense reflections: 0.0255
• Weighted residual factors for significantly intense reflections: 0.053
• Weighted residual factors for all reflections included in the refinement: 0.056
• Goodness-of-fit parameter for all reflections included in the refinement: 1.046
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No