Information card for entry 7244476

Structure parameters

• Formula: C11 H12 Cu F N O4
• Calculated formula: C11 H12 Cu F N O4
• Title of publication: Structural transformation of copper coordination complexes accompanied with chiral transformation
• Authors of publication: Li, Zhongkui; Su, Hao; Zhu, Yanhong; Yan, Li; Li, Hui
• Journal of publication: CrystEngComm
• Year of publication: 2022
• a: 7.7611 ± 0.0012 Å
• b: 14.453 ± 0.002 Å
• c: 20.556 ± 0.003 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 2305.8 ± 0.6 ų
• Cell temperature: 296 ± 2 K
• Ambient diffraction temperature: 296 ± 2 K
• Number of distinct elements: 6
• Space group number: 61
• Hermann-Mauguin space group symbol: P b c a
• Hall space group symbol: -P 2ac 2ab
• Residual factor for all reflections: 0.0509
• Residual factor for significantly intense reflections: 0.032
• Weighted residual factors for significantly intense reflections: 0.0776
• Weighted residual factors for all reflections included in the refinement: 0.0852
• Goodness-of-fit parameter for all reflections included in the refinement: 1.076
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No