Information card for entry 2230499

Structure parameters

• Chemical name: (1<i>E</i>,2<i>E</i>)-1,2-Bis(3-bromo-4-methoxybenzylidene)hydrazine
• Formula: C16 H14 Br2 N2 O2
• Calculated formula: C16 H14 Br2 N2 O2
• SMILES: Brc1c(OC)ccc(c1)/C=N/N=C/c1cc(Br)c(OC)cc1
• Title of publication: (1<i>E</i>,2<i>E</i>)-1,2-Bis(3-bromo-4-methoxybenzylidene)hydrazine
• Authors of publication: Jasinski, Jerry P.; Golen, James A.; Chidan Kumar, C. S.; Narayana, B.; Yathirajan, H. S.
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2011
• Journal volume: 67
• Journal issue: 6
• Pages of publication: o1379
• a: 10.1354 ± 0.0008 Å
• b: 10.55 ± 0.001 Å
• c: 15.6055 ± 0.0012 Å
• α: 90°
• β: 96.68 ± 0.007°
• γ: 90°
• Cell volume: 1657.3 ± 0.2 ų
• Cell temperature: 173 ± 2 K
• Ambient diffraction temperature: 173 ± 2 K
• Number of distinct elements: 5
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/c 1
• Hall space group symbol: -P 2ybc
• Residual factor for all reflections: 0.0919
• Residual factor for significantly intense reflections: 0.0527
• Weighted residual factors for significantly intense reflections: 0.1045
• Weighted residual factors for all reflections included in the refinement: 0.12
• Goodness-of-fit parameter for all reflections included in the refinement: 1.088
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes