Information card for entry 2013861

Structure parameters

• Chemical name: catena-poly[[bis[μ-1-(3-pyridyl)ethanone oxime-κ^2^N:N']dicopper(I)]-di-μ-iodo]
• Formula: C14 H16 Cu2 I2 N4 O2
• Calculated formula: C14 H16 Cu2 I2 N4 O2
• SMILES: [I]1[Cu]23([I][Cu]12[n]1cc(ccc1)C(=NO)C)[n]1cc(ccc1)C(C)=[N](O)[Cu]12([n]4cc(ccc4)C(=[N]3O)C)[I][Cu]1([I]2)[n]1cc(ccc1)C(=NO)C
• Title of publication: Ag^I^ and Cu^I^ binuclear macrocyclic complexes with 1-(3-pyridyl)ethanone oxime
• Authors of publication: Ingrid Socorro; Antonia Neels; Helen Stoeckli-Evans
• Journal of publication: Acta Crystallographica Section C
• Year of publication: 2004
• Journal volume: 60
• Journal issue: 1
• Pages of publication: m13 - m15
• a: 7.512 ± 0.001 Å
• b: 8.015 ± 0.001 Å
• c: 8.886 ± 0.001 Å
• α: 111.88 ± 0.02°
• β: 101.38 ± 0.02°
• γ: 106.57 ± 0.02°
• Cell volume: 447.28 ± 0.17 ų
• Cell temperature: 153 ± 2 K
• Ambient diffraction temperature: 153 ± 2 K
• Number of distinct elements: 6
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0209
• Residual factor for significantly intense reflections: 0.0195
• Weighted residual factors for significantly intense reflections: 0.0493
• Weighted residual factors for all reflections included in the refinement: 0.0499
• Goodness-of-fit parameter for all reflections included in the refinement: 1.07
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes