Information card for entry 2220266

Structure parameters

• Chemical name: Bis{2-methoxy-6-[(3-methoxypropyl)iminomethyl]phenolato- κ^2^N,<i>O</i>^1^}copper(II)
• Formula: C24 H32 Cu N2 O6
• Calculated formula: C24 H32 Cu N2 O6
• SMILES: C1c2c(O[Cu]3([N]=1CCCOC)[N](=Cc1c(c(ccc1)OC)O3)CCCOC)c(ccc2)OC
• Title of publication: Bis{2-methoxy-6-[(3-methoxypropyl)iminomethyl]phenolato-κ^2^<i>N</i>,<i>O</i>^1^}copper(II)
• Authors of publication: Datta, Amitabha; Huang, Jui-Hsien; Lee, Hon Man
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2008
• Journal volume: 64
• Journal issue: 12
• Pages of publication: m1497
• a: 11.2189 ± 0.0009 Å
• b: 10.7004 ± 0.0008 Å
• c: 9.5002 ± 0.0007 Å
• α: 90°
• β: 96.912 ± 0.001°
• γ: 90°
• Cell volume: 1132.18 ± 0.15 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: 0.0304
• Residual factor for significantly intense reflections: 0.0272
• Weighted residual factors for significantly intense reflections: 0.0774
• Weighted residual factors for all reflections included in the refinement: 0.0787
• Goodness-of-fit parameter for all reflections included in the refinement: 1.086
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes