Information card for entry 2243371

Structure parameters

• Chemical name: 4-{[(Anthracen-9-yl)methyl]amino}benzoic acid dimethylformamide monosolvate#
• Formula: C25 H24 N2 O3
• Calculated formula: C25 H24 N2 O3
• Title of publication: Crystal structure and Hirshfeld surface analysis of 4-{[(anthracen-9-yl)methyl]amino}benzoic acid dimethylformamide monosolvate
• Authors of publication: Ahmed, Adeeba; Ahmad, Aiman; Ahmad, Musheer; Kalibabchuk, Valentina A.
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2020
• Journal volume: 76
• Journal issue: 5
• Pages of publication: 728 - 731
• a: 10.6878 ± 0.0009 Å
• b: 8.9088 ± 0.0007 Å
• c: 21.9503 ± 0.0019 Å
• α: 90°
• β: 99.049 ± 0.003°
• γ: 90°
• Cell volume: 2064 ± 0.3 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 4
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/n 1
• Hall space group symbol: -P 2yn
• Residual factor for all reflections: 0.0936
• Residual factor for significantly intense reflections: 0.0571
• Weighted residual factors for significantly intense reflections: 0.1422
• Weighted residual factors for all reflections included in the refinement: 0.1835
• Goodness-of-fit parameter for all reflections included in the refinement: 1.1201
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes