Information card for entry 2235639

Structure parameters

• Chemical name: 4,6-Dibromo-2-[(<i>E</i>)-(4-{[(<i>E</i>)-3,5-dibromo-2-hydroxybenzylidene]amino}butyl)iminomethyl]phenol
• Formula: C18 H16 Br4 N2 O2
• Calculated formula: C18 H16 Br4 N2 O2
• SMILES: Brc1cc(/C=N/CCCC/N=C/c2cc(Br)cc(c2O)Br)c(c(c1)Br)O
• Title of publication: 4,6-Dibromo-2-[(<i>E</i>)-(4-{[(<i>E</i>)-3,5-dibromo-2-hydroxybenzylidene]amino}butyl)iminomethyl]phenol
• Authors of publication: Kargar, Hadi; Kia, Reza; Adabi Ardakani, Amir; Tahir, Muhammad Nawaz
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2012
• Journal volume: 68
• Journal issue: 7
• Pages of publication: o2270 - o2271
• a: 15.9537 ± 0.0012 Å
• b: 12.8784 ± 0.001 Å
• c: 9.5566 ± 0.0006 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 1963.5 ± 0.2 ų
• Cell temperature: 291 ± 2 K
• Ambient diffraction temperature: 291 ± 2 K
• Number of distinct elements: 5
• Space group number: 60
• Hermann-Mauguin space group symbol: P b c n
• Hall space group symbol: -P 2n 2ab
• Residual factor for all reflections: 0.0747
• Residual factor for significantly intense reflections: 0.0347
• Weighted residual factors for significantly intense reflections: 0.065
• Weighted residual factors for all reflections included in the refinement: 0.0743
• Goodness-of-fit parameter for all reflections included in the refinement: 0.993
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes