Information card for entry 2242741

Structure parameters

• Chemical name: (<i>E</i>)-4-Chloro-<i>N</i>'-(4-chlorobenzylidene)benzenesulfonohydrazide
• Formula: C13 H10 Cl2 N2 O2 S
• Calculated formula: C13 H10 Cl2 N2 O2 S
• SMILES: c1(ccc(cc1)Cl)S(=O)(=O)N/N=C/c1ccc(cc1)Cl
• Title of publication: Crystal structure and Hirshfeld surface analysis of two (<i>E</i>)-<i>N</i>'-(<i>para</i>-substituted benzylidene) 4-chlorobenzenesulfonohydrazides
• Authors of publication: Salian, Akshatha R.; Foro, Sabine; Gowda, B. Thimme
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2018
• Journal volume: 74
• Journal issue: 12
• Pages of publication: 1808 - 1814
• a: 5.9306 ± 0.0006 Å
• b: 9.477 ± 0.001 Å
• c: 13.04 ± 0.002 Å
• α: 98.822 ± 0.009°
• β: 96.046 ± 0.009°
• γ: 92.416 ± 0.009°
• Cell volume: 718.94 ± 0.15 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 6
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0433
• Residual factor for significantly intense reflections: 0.0379
• Weighted residual factors for significantly intense reflections: 0.0981
• Weighted residual factors for all reflections included in the refinement: 0.1022
• Goodness-of-fit parameter for all reflections included in the refinement: 1.078
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes