Information card for entry 2228789

Structure parameters

• Common name: {1,1'-[Butane-1,4-diylbis(nitrilomethylidyne)]di-2-naphtholato}copper(II) ethanol monosolvate
• Chemical name: Bis(2-hydroxynaphtylidene)-1,4-butanediamine copper (II) ethanol solvate
• Formula: C28 H28 Cu N2 O3
• Calculated formula: C28 H28 Cu N2 O3
• SMILES: [Cu]123Oc4ccc5ccccc5c4C=[N]2CCCC[N]3=Cc2c3ccccc3ccc2O1.OCC
• Title of publication: {1,1'-[Butane-1,4-diylbis(nitrilomethylidyne)]di-2-naphtholato}copper(II) ethanol monosolvate
• Authors of publication: Kargar, Hadi; Kia, Reza
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2011
• Journal volume: 67
• Journal issue: 1
• Pages of publication: m128
• a: 13.468 ± 0.003 Å
• b: 22.606 ± 0.005 Å
• c: 15.831 ± 0.003 Å
• α: 90°
• β: 95.84 ± 0.03°
• γ: 90°
• Cell volume: 4794.9 ± 1.8 ų
• Cell temperature: 296 ± 2 K
• Ambient diffraction temperature: 296 ± 2 K
• Number of distinct elements: 5
• Space group number: 15
• Hermann-Mauguin space group symbol: C 1 2/c 1
• Hall space group symbol: -C 2yc
• Residual factor for all reflections: 0.0984
• Residual factor for significantly intense reflections: 0.0572
• Weighted residual factors for significantly intense reflections: 0.1134
• Weighted residual factors for all reflections included in the refinement: 0.126
• Goodness-of-fit parameter for all reflections included in the refinement: 1.039
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes