Information card for entry 2016681

Structure parameters

• Chemical name: catena-poly[[[tetrakis(μ-acetato-κ^2^<i>O</i>:<i>O</i>')dicopper(II)]- μ~2~-4,4'-(<i>p</i>-phenylene)bipyridazine-κ^2^N^1^:N^1'^] chloroform disolvate]
• Formula: C24 H24 Cl6 Cu2 N4 O8
• Calculated formula: C24 H24 Cl6 Cu2 N4 O8
• SMILES: [Cu]1234([n]5ncc(cc5)c5ccc(cc5)c5cnncc5)[Cu]([O]=C(O1)C)(OC(=[O]2)C)([O]=C(O3)C)(OC(=[O]4)C)[n]1ncc(cc1)c1ccc(cc1)c1cn[n](cc1)[Cu]1234[Cu]([O]=C(O1)C)(OC(=[O]2)C)([O]=C(O3)C)OC(=[O]4)C.ClC(Cl)Cl.ClC(Cl)Cl.ClC(Cl)Cl.ClC(Cl)Cl
• Title of publication: Copper(II) bromide and copper(II) acetate complexes of 4,4'-(<i>p</i>-phenylene)bipyridazine
• Authors of publication: Degtyarenko, Anna S.; Solntsev, Pavlo V.; Rusanov, Eduard B.; Chernega, Alexander N.; Domasevitch, Konstantin V.
• Journal of publication: Acta Crystallographica Section C
• Year of publication: 2008
• Journal volume: 64
• Journal issue: 7
• Pages of publication: m254 - m258
• a: 7.6349 ± 0.0008 Å
• b: 8.0203 ± 0.0008 Å
• c: 13.9312 ± 0.001 Å
• α: 104.601 ± 0.002°
• β: 103.993 ± 0.002°
• γ: 90.123 ± 0.003°
• Cell volume: 799.21 ± 0.13 ų
• Cell temperature: 296 ± 2 K
• Ambient diffraction temperature: 296 ± 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: 0.0531
• Residual factor for significantly intense reflections: 0.0402
• Weighted residual factors for significantly intense reflections: 0.0862
• Weighted residual factors for all reflections included in the refinement: 0.0899
• Goodness-of-fit parameter for all reflections included in the refinement: 1.073
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes