Information card for entry 2006010

Structure parameters

• Chemical name: N-bezenesulfonyl-3-methylbenz[f]indole
• Formula: C19 H15 N O2 S
• Calculated formula: C19 H15 N O2 S
• SMILES: Cc1cn(c2c1cc1ccccc1c2)S(=O)(=O)c1ccccc1
• Title of publication: <i>N</i>-Phenylsulfonyl-3-methylbenz[<i>f</i>]indole
• Authors of publication: Yokum, T. S.; Fronczek, F. R.
• Journal of publication: Acta Crystallographica Section C
• Year of publication: 1997
• Journal volume: 53
• Journal issue: 3
• Pages of publication: 362 - 363
• a: 8.1524 ± 0.0008 Å
• b: 9.3328 ± 0.0004 Å
• c: 11.4597 ± 0.0006 Å
• α: 66.924 ± 0.004°
• β: 78.185 ± 0.006°
• γ: 83.396 ± 0.005°
• Cell volume: 784.56 ± 0.1 ų
• Cell temperature: 293 K
• Number of distinct elements: 5
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for significantly intense reflections: 0.037
• Weighted residual factors for significantly intense reflections: 0.056
• Goodness-of-fit parameter for significantly intense reflections: 1.572
• Diffraction radiation wavelength: 1.54184 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No