Information card for entry 7241591

Structure parameters

• Formula: C38 H33 F N2 O2
• Calculated formula: C38 H33 F N2 O2
• Title of publication: Increasing the structural boundary of quasiracemate formation: 4-substituted naphthylamides
• Authors of publication: Craddock, Drew E.; Parks, McKenzie J.; Taylor, Lauren A.; Wagner, Benjamin L.; Ruf, Michael; Wheeler, Kraig A.
• Journal of publication: CrystEngComm
• Year of publication: 2021
• Journal volume: 23
• Journal issue: 1
• Pages of publication: 210 - 215
• a: 9.8518 ± 0.0004 Å
• b: 10.2278 ± 0.0004 Å
• c: 15.3791 ± 0.0004 Å
• α: 76.292 ± 0.002°
• β: 88.604 ± 0.002°
• γ: 72.362 ± 0.001°
• Cell volume: 1432.83 ± 0.09 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 5
• Space group number: 1
• Hermann-Mauguin space group symbol: P 1
• Hall space group symbol: P 1
• Residual factor for all reflections: 0.0325
• Residual factor for significantly intense reflections: 0.0315
• Weighted residual factors for significantly intense reflections: 0.087
• Weighted residual factors for all reflections included in the refinement: 0.0879
• Goodness-of-fit parameter for all reflections included in the refinement: 1.073
• Diffraction radiation wavelength: 1.54178 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No