Information card for entry 2214691

Structure parameters

• Chemical name: 2'-(2-Methyl-1<i>H</i>-indol-3-ylmethylene)benzenesulfonohydrazide
• Formula: C16 H15 N3 O2 S
• Calculated formula: C16 H15 N3 O2 S
• SMILES: S(=O)(=O)(NN=Cc1c2c([nH]c1C)cccc2)c1ccccc1
• Title of publication: 2'-(2-Methyl-1<i>H</i>-indol-3-ylmethylene)benzenesulfonohydrazide
• Authors of publication: Ali, Hapipah M.; Yusnita, Juahir; Wan Jefrey, Basirun; Ng, Seik Weng
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2007
• Journal volume: 63
• Journal issue: 8
• Pages of publication: o3513 - o3513
• a: 11.1512 ± 0.0011 Å
• b: 19.243 ± 0.002 Å
• c: 6.9905 ± 0.0008 Å
• α: 90°
• β: 105.076 ± 0.006°
• γ: 90°
• Cell volume: 1448.4 ± 0.3 ų
• Cell temperature: 173 ± 2 K
• Ambient diffraction temperature: 173 ± 2 K
• Number of distinct elements: 5
• 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: 0.1362
• Residual factor for significantly intense reflections: 0.0706
• Weighted residual factors for significantly intense reflections: 0.1579
• Weighted residual factors for all reflections included in the refinement: 0.2125
• Goodness-of-fit parameter for all reflections included in the refinement: 1.145
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes