Information card for entry 2242756

Structure parameters

• Chemical name: (<i>E</i>)-4-Chloro-<i>N</i>'-[4-(piperidin-1-yl)benzylidene]benzenesulfonohydrazide
• Formula: C18 H20 Cl N3 O2 S
• Calculated formula: C18 H20 Cl N3 O2 S
• SMILES: Clc1ccc(S(=O)(=O)N/N=C/c2ccc(N3CCCCC3)cc2)cc1
• Title of publication: Crystal structure and Hirshfeld surface analysis of (<i>E</i>)-<i>N</i>'-[4-(piperidin-1-yl)benzylidene]arylsulfonohydrazides
• Authors of publication: Pai, Nikhila; 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: 1826 - 1832
• a: 33.052 ± 0.006 Å
• b: 5.258 ± 0.001 Å
• c: 43.026 ± 0.008 Å
• α: 90°
• β: 94.05 ± 0.02°
• γ: 90°
• Cell volume: 7459 ± 2 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 6
• Space group number: 15
• Hermann-Mauguin space group symbol: C 1 2/c 1
• Hall space group symbol: -C 2yc
• Residual factor for all reflections: 0.1848
• Residual factor for significantly intense reflections: 0.0751
• Weighted residual factors for significantly intense reflections: 0.133
• Weighted residual factors for all reflections included in the refinement: 0.172
• Goodness-of-fit parameter for all reflections included in the refinement: 1.013
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes