Information card for entry 4512413

Structure parameters

• Formula: C38 H28 F6 N4 O4
• Calculated formula: C38 H28 F6 N4 O4
• Title of publication: Fenamate Cocrystals with 4,4′-Bipyridine: Structural and Thermodynamic Aspects
• Authors of publication: Surov, Artem O.; Simagina, Anna A.; Manin, Nikolay G.; Kuzmina, Lyudmila G.; Churakov, Andrei V.; Perlovich, German L.
• Journal of publication: Crystal Growth & Design
• Year of publication: 2015
• Journal volume: 15
• Journal issue: 1
• Pages of publication: 228
• a: 9.8384 ± 0.0011 Å
• b: 10.3962 ± 0.0011 Å
• c: 25.015 ± 0.003 Å
• α: 84.632 ± 0.002°
• β: 81.353 ± 0.002°
• γ: 71.679 ± 0.002°
• Cell volume: 2398.4 ± 0.5 ų
• Cell temperature: 153 ± 2 K
• Ambient diffraction temperature: 153 ± 2 K
• Number of distinct elements: 5
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.1139
• Residual factor for significantly intense reflections: 0.0583
• Weighted residual factors for significantly intense reflections: 0.1408
• Weighted residual factors for all reflections included in the refinement: 0.1669
• Goodness-of-fit parameter for all reflections included in the refinement: 1.019
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No