Information card for entry 2240648

Structure parameters

• Common name: (E,E)-thiene-2,5-diylbis[N-(4-methylphenyl)methanimine]
• Chemical name: <i>N</i>,<i>N</i>'-[(Thiophene-2,5-diyl)bis(methanylylidene)]di-<i>p</i>-toluidine
• Formula: C20 H18 N2 S
• Calculated formula: C20 H18 N2 S
• SMILES: s1c(ccc1/C=N/c1ccc(cc1)C)/C=N/c1ccc(cc1)C
• Title of publication: Crystal structure of <i>N</i>,<i>N</i>'-[(thiophene-2,5-diyl)bis(methanylylidene)]di-<i>p</i>-toluidine
• Authors of publication: Boyle, Raina; Crundwell, Guy; Glagovich, Neil M.
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2015
• Journal volume: 71
• Journal issue: 6
• Pages of publication: o403
• a: 37.166 ± 0.002 Å
• b: 6.0292 ± 0.0002 Å
• c: 7.5814 ± 0.0004 Å
• α: 90°
• β: 93.452 ± 0.007°
• γ: 90°
• Cell volume: 1695.77 ± 0.14 ų
• Cell temperature: 298 ± 2 K
• Ambient diffraction temperature: 298 ± 2 K
• Number of distinct elements: 4
• 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: 0.0662
• Residual factor for significantly intense reflections: 0.0482
• Weighted residual factors for significantly intense reflections: 0.1295
• Weighted residual factors for all reflections included in the refinement: 0.1445
• Goodness-of-fit parameter for all reflections included in the refinement: 1.032
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes