Information card for entry 2238561

Structure parameters

• Chemical name: 1-{2-[(<i>E</i>)-2-(2-Nitrophenyl)ethenyl]-1-phenylsulfonyl-1<i>H</i>-indol-3-yl}ethanone
• Formula: C24 H18 N2 O5 S
• Calculated formula: C24 H18 N2 O5 S
• SMILES: c12ccccc1c(c(/C=C/c1ccccc1N(=O)=O)n2S(=O)(=O)c1ccccc1)C(=O)C
• Title of publication: 1-{2-[(<i>E</i>)-2-(2-Nitrophenyl)ethenyl]-1-phenylsulfonyl-1<i>H</i>-indol-3-yl}ethanone
• Authors of publication: Karthikeyan, S.; Sethusankar, K.; Saravanan, Velu; Mohanakrishnan, Arasambattu K.
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2013
• Journal volume: 69
• Journal issue: 9
• Pages of publication: o1422 - o1423
• a: 8.2409 ± 0.0008 Å
• b: 16.1702 ± 0.0015 Å
• c: 15.37 ± 0.0015 Å
• α: 90°
• β: 95.775 ± 0.005°
• γ: 90°
• Cell volume: 2037.8 ± 0.3 ų
• Cell temperature: 296 ± 2 K
• Ambient diffraction temperature: 296 ± 2 K
• Number of distinct elements: 5
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/n 1
• Hall space group symbol: -P 2yn
• Residual factor for all reflections: 0.0549
• Residual factor for significantly intense reflections: 0.041
• Weighted residual factors for significantly intense reflections: 0.1086
• Weighted residual factors for all reflections included in the refinement: 0.118
• Goodness-of-fit parameter for all reflections included in the refinement: 1.02
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes