Information card for entry 4320091

Structure parameters

• Chemical name: (4,4'-dimethyl-2,2'-bipyridine)dicopper(II)tetrabromide
• Formula: C12 H14 Br4 Cu2 N2
• Calculated formula: C12 H12 Br4 Cu2 N2
• SMILES: c12c3cc(cc[n]3[Cu]3([n]2ccc(c1)C)[Br][Cu]([Br]3)(Br)Br)C
• Title of publication: Crystal Chemistry of the 4,4'-Dimethyl-2,2'bipyridine/Copper Bromide System
• Authors of publication: Roger D. Willett; George Pon; Callie Nagy
• Journal of publication: Inorganic Chemistry
• Year of publication: 2001
• Journal volume: 40
• Pages of publication: 4342 - 4352
• a: 17.3718 ± 0.0005 Å
• b: 13.3189 ± 0.0001 Å
• c: 7.4432 ± 0.0002 Å
• α: 90°
• β: 110.686 ± 0.002°
• γ: 90°
• Cell volume: 1611.13 ± 0.07 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 5
• Space group number: 15
• Hermann-Mauguin space group symbol: C 1 2/c 1
• Hall space group symbol: -C 2yc
• Residual factor for all reflections: 0.1777
• Residual factor for significantly intense reflections: 0.056
• Weighted residual factors for significantly intense reflections: 0.1288
• Weighted residual factors for all reflections included in the refinement: 0.1579
• Goodness-of-fit parameter for all reflections included in the refinement: 1.118
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No