Information card for entry 1559969

Structure parameters

• Common name: Tetrakis(2,2'-bipyridyl)-mu-nitratodicopper(II) Hexafluorophosphate
• Formula: C40 H32 Cu2 F18 N9 O3 P3
• Calculated formula: C40 Cu2 F18 N9 O3 P3
• SMILES: [Cu]123([O]=N(=[O][Cu]45([n]6ccccc6c6[n]4cccc6)[n]4ccccc4c4[n]5cccc4)O1)([n]1ccccc1c1[n]2cccc1)[n]1ccccc1c1[n]3cccc1.[P](F)(F)(F)(F)(F)[F-].[P](F)(F)(F)(F)(F)[F-].[P](F)(F)(F)(F)(F)[F-]
• Title of publication: The Plasticity of Cu(II) in [Cu(bipyridyl)2X]n+ Chromophores. Crystal and Molecular Structure of Tetrakis(2,2'-bipyridyl)-mu-nitratodicopper(II) Hexafluorophosphate
• Authors of publication: Sletten, Jorunn; Sorensen, Astrid
• Journal of publication: Acta Chemica Scandinavica
• Year of publication: 1990
• Journal volume: 44
• Pages of publication: 1018 - 1023
• a: 11.918 ± 0.006 Å
• b: 14.25 ± 0.004 Å
• c: 15.013 ± 0.005 Å
• α: 85.51 ± 0.02°
• β: 68.81 ± 0.02°
• γ: 76.67 ± 0.02°
• Cell volume: 2313.2 ± 1.6 ų
• Ambient diffraction temperature: 294 K
• Number of distinct elements: 7
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for significantly intense reflections: 0.094
• Weighted residual factors for significantly intense reflections: 0.085
• Goodness-of-fit parameter for all reflections included in the refinement: 3.38
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No