Information card for entry 2015465

Structure parameters

• Chemical name: Dichloro[(1E,1'E)-1,1'-(pyridine-2,6-diyl)diethanone bis(O-methyloxime)-κ^2^N^2^,N^6^]copper(II)
• Formula: C11 H15 Cl2 Cu N3 O2
• Calculated formula: C11 H15 Cl2 Cu N3 O2
• SMILES: [Cu]12(Cl)(Cl)[n]3c(cccc3C(=[N]1OC)C)C(=[N]2OC)C
• Title of publication: Dichloro[(1<i>E</i>,1'<i>E</i>)-1,1'-(pyridine-2,6-diyl)diethanone bis(<i>O</i>-methyloxime)-κ^3^<i>N</i>^1^,<i>N</i>^2^,<i>N</i>^6^]copper(II)
• Authors of publication: Özdemir, Namık; Dinçer, Muharrem; Dayan, Osman; Çetinkaya, Bekir
• Journal of publication: Acta Crystallographica Section C
• Year of publication: 2006
• Journal volume: 62
• Journal issue: 7
• Pages of publication: m315 - m318
• a: 11.1308 ± 0.0006 Å
• b: 10.4656 ± 0.0005 Å
• c: 13.6747 ± 0.0007 Å
• α: 90°
• β: 115.152 ± 0.004°
• γ: 90°
• Cell volume: 1441.93 ± 0.14 ų
• Cell temperature: 296 K
• Ambient diffraction temperature: 296 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: 0.0356
• Residual factor for significantly intense reflections: 0.0308
• Weighted residual factors for significantly intense reflections: 0.0842
• Weighted residual factors for all reflections included in the refinement: 0.0867
• Goodness-of-fit parameter for all reflections included in the refinement: 1.053
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes