Information card for entry 4000113

Structure parameters

• Formula: C26 H31 Cl2 Cu N4 O1.5
• Calculated formula: C26 H28 Cl2 Cu N4 O1.5
• Journal of publication: Chemistry of Materials
• Year of publication: 2002
• a: 16.3139 ± 0.0012 Å
• b: 18.2111 ± 0.0013 Å
• c: 36.247 ± 0.003 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 10768.8 ± 1.4 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 6
• Space group number: 19
• Hermann-Mauguin space group symbol: P 21 21 21
• Hall space group symbol: P 2ac 2ab
• Residual factor for all reflections: 0.1032
• Residual factor for significantly intense reflections: 0.0824
• Weighted residual factors for all reflections: 0.2533
• Weighted residual factors for significantly intense reflections: 0.2266
• Goodness-of-fit parameter for all reflections: 1.044
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No