Information card for entry 4337529

Structure parameters

• Formula: C22 H20 Cu3 N10 O14 S2
• Calculated formula: C22 H20 Cu3 N10 O14 S2
• Title of publication: Anion-tunable configuration isomerism and magnetic coupling in a tetranuclear discrete, one-dimensional (1D) chiral chain and 1D-decker copper(II) complexes of a carbohydrazine derivative.
• Authors of publication: Huang, Wei; Jin, Yuchao; Wu, Dayu; Wu, Genhua
• Journal of publication: Inorganic chemistry
• Year of publication: 2014
• Journal volume: 53
• Journal issue: 1
• Pages of publication: 73 - 79
• a: 7.3833 ± 0.0003 Å
• b: 8.5042 ± 0.0003 Å
• c: 12.6894 ± 0.0005 Å
• α: 80.127 ± 0.002°
• β: 80.033 ± 0.003°
• γ: 79.988 ± 0.002°
• Cell volume: 764.53 ± 0.05 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: 0.0852
• Residual factor for significantly intense reflections: 0.0767
• Weighted residual factors for significantly intense reflections: 0.1855
• Weighted residual factors for all reflections included in the refinement: 0.1886
• Goodness-of-fit parameter for all reflections included in the refinement: 1.234
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No