Information card for entry 8102869

Structure parameters

• Formula: C21 H17 Cl Cu N4 O6
• Calculated formula: C21 H17 Cl Cu N4 O6
• SMILES: [Cu]12([n]3ccccc3c3[n]1cccc3)([n]1ccccc1c1[n]2cccc1)OC=O.[O-]Cl(=O)(=O)=O
• Title of publication: Crystal structure of bis(2,2'-bipyridine)formatocopper(II) tetrachlorate, [Cu(C10H8N2)2(CHO2)][ClO4]
• Authors of publication: Qin Huang; Li-Hong Diao; Xian-Hong Yin
• Journal of publication: Zeitschrift für Kristallographie - New Crystal Structures
• Year of publication: 2010
• Journal volume: 225
• Journal issue: 4
• Pages of publication: 735
• a: 7.248 ± 0.009 Å
• b: 10.605 ± 0.013 Å
• c: 28.22 ± 0.04 Å
• α: 90°
• β: 96.732 ± 0.016°
• γ: 90°
• Cell volume: 2154 ± 5 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 6
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/c 1
• Hall space group symbol: -P 2ybc
• Residual factor for all reflections: 0.077
• Residual factor for significantly intense reflections: 0.0547
• Weighted residual factors for significantly intense reflections: 0.1457
• Weighted residual factors for all reflections included in the refinement: 0.1568
• 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: No