Information card for entry 8107696

Structure parameters

• Formula: C31 H28 N2 O2
• Calculated formula: C31 H28 N2 O2
• SMILES: O/N=C/c1ccc(cc1)c1cc2c(cc1)c1c(cc(cc1)c1ccc(cc1)/C=N/O)C2(CC)CC
• Title of publication: Crystal structure of (1E,1′E)-4,4′-(9,9-diethyl-9H-fluorene-2,7-diyl)dibenzaldehyde dioxime, C31H28N2O2
• Authors of publication: Ma, Ying-Hong; Zhao, Hong-Yan; Tian, Yu; Wu, Yi; Wang, Lei
• Journal of publication: Zeitschrift für Kristallographie - New Crystal Structures
• Year of publication: 2023
• Journal volume: 238
• Journal issue: 6
• Pages of publication: 1181 - 1183
• a: 9.0809 ± 0.0009 Å
• b: 9.2626 ± 0.0009 Å
• c: 14.854 ± 0.0015 Å
• α: 93.574 ± 0.008°
• β: 98.554 ± 0.008°
• γ: 99.558 ± 0.008°
• Cell volume: 1213.5 ± 0.2 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 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: 0.0871
• Residual factor for significantly intense reflections: 0.0541
• Weighted residual factors for significantly intense reflections: 0.1191
• Weighted residual factors for all reflections included in the refinement: 0.1424
• Goodness-of-fit parameter for all reflections included in the refinement: 1.044
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No