Information card for entry 2219581

Structure parameters

• Chemical name: Bis[1-(1-adamantyliminomethyl)-2-naphtholato- κ^2^<i>N</i>,<i>O</i>]cobalt(II)
• Formula: C42 H44 Co N2 O2
• Calculated formula: C42 H44 Co N2 O2
• SMILES: [Co]12(Oc3ccc4ccccc4c3C=[N]1C13CC4CC(C1)CC(C4)C3)Oc1ccc3ccccc3c1C=[N]2C12CC3CC(C1)CC(C3)C2
• Title of publication: Bis[1-(1-adamantyliminomethyl)-2-naphtholato-κ^2^<i>N</i>,<i>O</i>]cobalt(II)
• Authors of publication: Franco, Jimmy U.; Olmstead, Marilyn M.; Hammons, Justin C.
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2008
• Journal volume: 64
• Journal issue: 10
• Pages of publication: m1223
• a: 13.9055 ± 0.0005 Å
• b: 14.3576 ± 0.0005 Å
• c: 19.5899 ± 0.0006 Å
• α: 69.938 ± 0.002°
• β: 71.219 ± 0.002°
• γ: 68.473 ± 0.002°
• Cell volume: 3330.4 ± 0.2 ų
• Cell temperature: 90 ± 2 K
• Ambient diffraction temperature: 90 ± 2 K
• Number of distinct elements: 5
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0527
• Residual factor for significantly intense reflections: 0.0359
• Weighted residual factors for significantly intense reflections: 0.0812
• Weighted residual factors for all reflections included in the refinement: 0.0877
• Goodness-of-fit parameter for all reflections included in the refinement: 1.023
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes