Information card for entry 7114983

Structure parameters

• Formula: C18 H52 Cu3 F18 N36 O8 Si3
• Calculated formula: C18 H50 Cu3 F18 N36 O8 Si3
• Title of publication: Counter anion dependent symmetry of CuII‒4-amino-1,2,4-triazole polymeric chains
• Authors of publication: Drabent, Krzysztof; Ciunik, Zbigniew
• Journal of publication: Chemical Communications
• Year of publication: 2001
• Journal issue: 14
• Pages of publication: 1254
• a: 12.417 ± 0.002 Å
• b: 13.15 ± 0.003 Å
• c: 18.03 ± 0.004 Å
• α: 73.63 ± 0.03°
• β: 72.64 ± 0.03°
• γ: 70.28 ± 0.03°
• Cell volume: 2590.8 ± 1.1 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 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 all reflections: 0.0868
• Residual factor for significantly intense reflections: 0.0511
• Weighted residual factors for significantly intense reflections: 0.142
• Weighted residual factors for all reflections included in the refinement: 0.1575
• Goodness-of-fit parameter for all reflections included in the refinement: 0.93
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No