Information card for entry 2207628

Structure parameters

• Formula: C20 H16 Cu I4 N4
• Calculated formula: C20 H16 Cu I4 N4
• SMILES: c1cccc2[n]1[Cu]1(I)([n]3ccccc3c3cccc[n]13)[n]1c2cccc1.[I-](I)I
• Title of publication: Redetermination of bis(2,2'-bipyridine)iodocopper(II) triiodide
• Authors of publication: Choi, Sung-Nak; Heo, Ji Youn; Ryu, Hae-Wook; Oh, Myung-Jin; Kang, Sung Kwon
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2005
• Journal volume: 61
• Journal issue: 12
• Pages of publication: m2658 - m2660
• a: 26.353 ± 0.003 Å
• b: 7.3649 ± 0.0007 Å
• c: 14.8434 ± 0.0016 Å
• α: 90°
• β: 120.057 ± 0.01°
• γ: 90°
• Cell volume: 2493.5 ± 0.5 ų
• Cell temperature: 295 ± 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 significantly intense reflections: 0.0436
• Weighted residual factors for all reflections included in the refinement: 0.0952
• Goodness-of-fit parameter for all reflections included in the refinement: 1.009
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes