Information card for entry 2204460

Structure parameters

• Chemical name: [N,N'-Bis(2-oxido-1-naphthylmethylene)propane-1,3-diamine]copper(II)
• Formula: C25 H20 Cu N2 O2
• Calculated formula: C25 H20 Cu N2 O2
• SMILES: c12C=[N]3[Cu]4(Oc1ccc1ccccc21)[N](=Cc1c(ccc2ccccc12)O4)CCC3
• Title of publication: [<i>N</i>,<i>N</i>'-Bis(2-oxido-1-naphthylmethylene)propane-1,3-diamine]copper(II)
• Authors of publication: Chen, Guang
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2004
• Journal volume: 60
• Journal issue: 11
• Pages of publication: m1550 - m1551
• a: 30.614 ± 0.006 Å
• b: 8.4578 ± 0.0017 Å
• c: 7.7462 ± 0.0015 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 2005.7 ± 0.7 ų
• Cell temperature: 273 ± 2 K
• Ambient diffraction temperature: 273 ± 2 K
• Number of distinct elements: 5
• Space group number: 36
• Hermann-Mauguin space group symbol: C m c 21
• Hall space group symbol: C 2c -2
• Residual factor for all reflections: 0.0524
• Residual factor for significantly intense reflections: 0.0473
• Weighted residual factors for significantly intense reflections: 0.1192
• Weighted residual factors for all reflections included in the refinement: 0.1235
• Goodness-of-fit parameter for all reflections included in the refinement: 1.012
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No