Information card for entry 2241273

Structure parameters

• Chemical name: Bis{1-[(<i>E</i>)-(2-methoxyphenyl)diazenyl]naphthalen-2-olato-κ^3^<i>O</i>,<i>N</i>^2^,<i>O</i>'}copper(II)
• Formula: C34 H26 Cu N4 O4
• Calculated formula: C34 H26 Cu N4 O4
• SMILES: [Cu]1234([O](c5c([N]3=Nc3c(O1)ccc1c3cccc1)cccc5)C)[O](c1c([N]4=Nc3c(O2)ccc2c3cccc2)cccc1)C
• Title of publication: Crystal structure of bis{1-[(<i>E</i>)-(2-methoxyphenyl)diazenyl]naphthalen-2-olato-κ^3^<i>O</i>,<i>N</i>^2^,<i>O</i>'}copper(II) containing an unknown solvate
• Authors of publication: Chetioui, Souheyla; Hamdouni, Noudjoud; Rouag, Djamil-Azzeddine; Bouaoud, Salah Eddine; Merazig, Hocine
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2015
• Journal volume: 71
• Journal issue: 11
• Pages of publication: m207 - m208
• a: 29.749 ± 0.002 Å
• b: 12.5171 ± 0.0009 Å
• c: 15.3565 ± 0.0012 Å
• α: 90°
• β: 92.969 ± 0.005°
• γ: 90°
• Cell volume: 5710.6 ± 0.7 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 5
• 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: 0.1969
• Residual factor for significantly intense reflections: 0.0736
• Weighted residual factors for significantly intense reflections: 0.1351
• Weighted residual factors for all reflections included in the refinement: 0.168
• Goodness-of-fit parameter for all reflections included in the refinement: 1.011
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes