Information card for entry 2208749

Structure parameters

• Common name: Bis(9-ethylcarbazol-3-yl)ethane
• Chemical name: Bis(9-ethyl-9H-carbazol-3-yl)ethane
• Formula: C30 H28 N2
• Calculated formula: C30 H28 N2
• SMILES: n1(c2c(c3cc(ccc13)CCc1ccc3n(c4c(c3c1)cccc4)CC)cccc2)CC
• Title of publication: Bis(9-ethylcarbazol-3-yl)ethane
• Authors of publication: Asker, Erol; Masnovi, John
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2006
• Journal volume: 62
• Journal issue: 4
• Pages of publication: o1213 - o1215
• a: 8.1412 ± 0.0005 Å
• b: 17.2919 ± 0.0019 Å
• c: 16.434 ± 0.002 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 2313.5 ± 0.4 ų
• Cell temperature: 295 ± 2 K
• Number of distinct elements: 3
• Space group number: 33
• Hermann-Mauguin space group symbol: P 21 c n
• Hall space group symbol: P -2n 2a
• Residual factor for all reflections: 0.1352
• Residual factor for significantly intense reflections: 0.0564
• Weighted residual factors for significantly intense reflections: 0.1099
• Weighted residual factors for all reflections included in the refinement: 0.1321
• Goodness-of-fit parameter for all reflections included in the refinement: 0.921
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No