Information card for entry 2016348

Structure parameters

• Chemical name: 9-[(<i>E</i>)-(3-nitrophenyl)vinyl]-9<i>H</i>-carbazole
• Formula: C20 H14 N2 O2
• Calculated formula: C20 H14 N2 O2
• SMILES: c1cccc2c3ccccc3n(c12)\C=C\c1cc(ccc1)N(=O)=O
• Title of publication: Two 9-[(<i>E</i>)-nitrophenylvinyl]-9<i>H</i>-carbazoles
• Authors of publication: Kubicki, Maciej; Prukała, Wiesław; Marciniec, Bogdan
• Journal of publication: Acta Crystallographica Section C
• Year of publication: 2007
• Journal volume: 63
• Journal issue: 12
• Pages of publication: o690 - o692
• a: 8.1085 ± 0.0016 Å
• b: 7.5179 ± 0.0011 Å
• c: 24.122 ± 0.004 Å
• α: 90°
• β: 90.507 ± 0.014°
• γ: 90°
• Cell volume: 1470.4 ± 0.4 ų
• Cell temperature: 100 ± 1 K
• Ambient diffraction temperature: 100 ± 1 K
• Number of distinct elements: 4
• 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: 0.1227
• Residual factor for significantly intense reflections: 0.0463
• Weighted residual factors for significantly intense reflections: 0.074
• Weighted residual factors for all reflections included in the refinement: 0.0922
• Goodness-of-fit parameter for all reflections included in the refinement: 0.992
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes