Information card for entry 2021928

Structure parameters

• Common name: Benzil dihydrazone-N,N'-bis(1-formylnaphthalene)
• Chemical name: (1<i>Z</i>,2<i>Z</i>)-1,2-Bis{(<i>E</i>)-[(naphthalen-1-yl)methylidene]hydrazinylidene}-1,2-diphenylethane
• Formula: C36 H26 N4
• Calculated formula: C36 H26 N4
• SMILES: C(=N\N=C\c1c2c(ccc1)cccc2)(/C(=N/N=C/c1c2ccccc2ccc1)c1ccccc1)c1ccccc1
• Title of publication: Synthesis, crystal structures, antiproliferative activities and reverse docking studies of eight novel Schiff bases derived from benzil
• Authors of publication: Tan, Xue-Jie; Wang, Di; Hei, Xiao-Ming; Yang, Feng-Cun; Zhu, Ya-Ling; Xing, Dian-Xiang; Ma, Jian-Ping
• Journal of publication: Acta Crystallographica Section C
• Year of publication: 2020
• Journal volume: 76
• Journal issue: 1
• Pages of publication: 44 - 63
• a: 26.195 ± 0.008 Å
• b: 9.809 ± 0.003 Å
• c: 11.806 ± 0.004 Å
• α: 90°
• β: 115.23 ± 0.005°
• γ: 90°
• Cell volume: 2744.1 ± 1.5 ų
• Cell temperature: 298 ± 2 K
• Ambient diffraction temperature: 298 ± 2 K
• Number of distinct elements: 3
• Space group number: 15
• Hermann-Mauguin space group symbol: C 1 2/c 1
• Hall space group symbol: -C 2yc
• Residual factor for all reflections: 0.1419
• Residual factor for significantly intense reflections: 0.0617
• Weighted residual factors for significantly intense reflections: 0.1093
• Weighted residual factors for all reflections included in the refinement: 0.1299
• Goodness-of-fit parameter for all reflections included in the refinement: 0.954
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes