Information card for entry 2221199

Structure parameters

• Chemical name: Bis[4-bromo-2-(cyclopentyliminomethyl)phenolato]copper(II)
• Formula: C24 H26 Br2 Cu N2 O2
• Calculated formula: C24 H26 Br2 Cu N2 O2
• SMILES: [Cu]12(Oc3c(cc(cc3)Br)C=[N]1C1CCCC1)[N](=Cc1c(ccc(c1)Br)O2)C1CCCC1
• Title of publication: Bis[4-bromo-2-(cyclopentyliminomethyl)phenolato]copper(II)
• Authors of publication: Cai, Bang-Hong
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2009
• Journal volume: 65
• Journal issue: 3
• Pages of publication: m339
• a: 9.19 ± 0.002 Å
• b: 10.96 ± 0.002 Å
• c: 12.166 ± 0.002 Å
• α: 90°
• β: 109.73 ± 0.03°
• γ: 90°
• Cell volume: 1153.5 ± 0.4 ų
• Cell temperature: 298 ± 2 K
• Ambient diffraction temperature: 298 ± 2 K
• Number of distinct elements: 6
• 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: 0.0576
• Residual factor for significantly intense reflections: 0.0393
• Weighted residual factors for significantly intense reflections: 0.0905
• Weighted residual factors for all reflections included in the refinement: 0.0983
• Goodness-of-fit parameter for all reflections included in the refinement: 1.021
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes