Information card for entry 4316751

Structure parameters

• Common name: Tetrafluoroterephthalic acid
• Chemical name: 2,3,5,6-Tetrafluoro-1,4-benzenedicarboxylic acid
• Formula: C8 H2 F4 O4
• Calculated formula: C8 H2 F4 O4
• Title of publication: Optimized Synthesis of Tetrafluoroterephthalic Acid: A Versatile Linking Ligand for the Construction of New Coordination Polymers and Metal-Organic Frameworks
• Authors of publication: Andreas Orthaber; Christiane Seidel; Ferdinand Belaj; Jörg H. Albering; Rudolf Pietschnig; Uwe Ruschewitz
• Journal of publication: Inorganic Chemistry
• Year of publication: 2010
• Journal volume: 49
• Pages of publication: 9350 - 9357
• a: 4.5649 ± 0.0017 Å
• b: 5.8322 ± 0.0017 Å
• c: 7.452 ± 0.002 Å
• α: 87.32 ± 0.03°
• β: 78.41 ± 0.03°
• γ: 74.11 ± 0.03°
• Cell volume: 186.92 ± 0.11 ų
• Cell temperature: 95 ± 2 K
• Ambient diffraction temperature: 95 ± 2 K
• Number of distinct elements: 4
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0401
• Residual factor for significantly intense reflections: 0.0342
• Weighted residual factors for significantly intense reflections: 0.0871
• Weighted residual factors for all reflections included in the refinement: 0.0914
• Goodness-of-fit parameter for all reflections included in the refinement: 1.075
• Diffraction radiation wavelength: 0.71069 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No