Information card for entry 2217356

Structure parameters

• Chemical name: (E)-4-Bromo-2-[(4-ethylphenyl)iminomethyl]phenol
• Formula: C15 H14 Br N O
• Calculated formula: C15 H14 Br N O
• SMILES: C(=N/c1ccc(cc1)CC)\c1cc(ccc1O)Br
• Title of publication: (<i>E</i>)-4-Bromo-2-[(4-ethylphenyl)iminomethyl]phenol
• Authors of publication: Atalay, Şehriman; Erdem, Talip Kaya; Erşahin, Ferda; Tınkılıç, Nihat
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2008
• Journal volume: 64
• Journal issue: 1
• Pages of publication: o92 - o92
• a: 6.228 ± 0.0006 Å
• b: 7.0292 ± 0.0007 Å
• c: 30.237 ± 0.004 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 1323.7 ± 0.3 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 5
• Space group number: 33
• Hermann-Mauguin space group symbol: P n a 21
• Hall space group symbol: P 2c -2n
• Residual factor for all reflections: 0.0739
• Residual factor for significantly intense reflections: 0.0413
• Weighted residual factors for significantly intense reflections: 0.0952
• Weighted residual factors for all reflections included in the refinement: 0.1087
• Goodness-of-fit parameter for all reflections included in the refinement: 0.922
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes