Information card for entry 5000361

Structure parameters

• Formula: C28 H28.2 Cl Cu2 N4 O9.4
• Calculated formula: C28 H24 Cl Cu2 N4 O9.4
• a: 7.7392 ± 0.0018 Å
• b: 34.342 ± 0.007 Å
• c: 11.052 ± 0.003 Å
• α: 90°
• β: 101.774 ± 0.012°
• γ: 90°
• Cell volume: 2875.5 ± 1.1 ų
• Cell temperature: 105 K
• Ambient diffraction temperature: 105 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 significantly intense reflections: 0.0614
• Weighted residual factors for all reflections included in the refinement: 0.0553
• Goodness-of-fit parameter for all reflections included in the refinement: 1.1265
• Diffraction radiation wavelength: 0.71069 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No