Information card for entry 2240551

Structure parameters

• Chemical name: (<i>E</i>)-<i>N</i>-(3,3-Diphenylallylidene)-9-ethyl-9<i>H</i>-carbazol-3-amine
• Formula: C29 H24 N2
• Calculated formula: C29 H24 N2
• SMILES: CCn1c2c(cc(/N=C/C=C(c3ccccc3)c3ccccc3)cc2)c2c1cccc2
• Title of publication: Crystal structure of (<i>E</i>)-<i>N</i>-(3,3-diphenylallylidene)-9-ethyl-9<i>H</i>-carbazol-3-amine
• Authors of publication: Thirumurthy, Kannan; Thirunarayanan, Ganesamoorthy; Murugavel, S.
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2015
• Journal volume: 71
• Journal issue: 4
• Pages of publication: 418 - 420
• a: 13.6502 ± 0.0017 Å
• b: 8.7616 ± 0.0013 Å
• c: 18.224 ± 0.002 Å
• α: 90°
• β: 92.234 ± 0.011°
• γ: 90°
• Cell volume: 2177.9 ± 0.5 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 3
• 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: 0.0948
• Residual factor for significantly intense reflections: 0.0556
• Weighted residual factors for significantly intense reflections: 0.1241
• Weighted residual factors for all reflections included in the refinement: 0.15
• Goodness-of-fit parameter for all reflections included in the refinement: 1.027
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes