Information card for entry 2204839

Structure parameters

• Chemical name: (Acetato-κ^2^O,O')(di-2-pyridylamine-κN)(trifluoroacetato-κO)copper(II)
• Formula: C14 H12 Cu F3 N3 O4
• Calculated formula: C14 H12 Cu F3 N3 O4
• SMILES: [Cu]12(OC(=[O]1)C)(OC(=O)C(F)(F)F)[n]1ccccc1Nc1[n]2cccc1
• Title of publication: (Acetato-κ^2^<i>O,O</i>')(di-2-pyridylamine-κ<i>N</i>)(trifluoroacetato-κ<i>O</i>)copper(II)
• Authors of publication: Zeng, Xi-Rui; Huang, Lin; Lei, Liang-Ping; Tang, Shi-Hua; Peng, Shie-Ming; Lee, Gene-Hsiang
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2005
• Journal volume: 61
• Journal issue: 1
• Pages of publication: m57 - m59
• a: 8.2533 ± 0.0011 Å
• b: 8.7907 ± 0.0015 Å
• c: 11.3643 ± 0.0014 Å
• α: 87.199 ± 0.015°
• β: 84.592 ± 0.014°
• γ: 73.62 ± 0.011°
• Cell volume: 787.3 ± 0.2 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 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: 0.0477
• Residual factor for significantly intense reflections: 0.0371
• Weighted residual factors for significantly intense reflections: 0.1162
• Weighted residual factors for all reflections included in the refinement: 0.1252
• Goodness-of-fit parameter for all reflections included in the refinement: 1.028
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes