Information card for entry 2227512

Structure parameters

• Chemical name: 4-{2-[(<i>Z</i>)-(5-Methyl-2-furyl)methylideneamino]ethyl}benzenesulfonamide
• Formula: C14 H16 N2 O3 S
• Calculated formula: C14 H16 N2 O3 S
• SMILES: S(=O)(=O)(N)c1ccc(cc1)CC/N=C/c1oc(cc1)C
• Title of publication: 4-{2-[(<i>Z</i>)-(5-Methyl-2-furyl)methylideneamino]ethyl}benzenesulfonamide
• Authors of publication: Mahmood, Khalid; Yaqub, Muhammad; Tahir, M. Nawaz; Shafiq, Zahid; Qureshi, Ashfaq Mahmood
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2010
• Journal volume: 66
• Journal issue: 9
• Pages of publication: o2436
• a: 9.1947 ± 0.0014 Å
• b: 9.7592 ± 0.0014 Å
• c: 9.8493 ± 0.0015 Å
• α: 61.027 ± 0.006°
• β: 70.65 ± 0.006°
• γ: 81.574 ± 0.007°
• Cell volume: 729.4 ± 0.2 ų
• Cell temperature: 296 ± 2 K
• Ambient diffraction temperature: 296 ± 2 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 all reflections: 0.1171
• Residual factor for significantly intense reflections: 0.0577
• Weighted residual factors for significantly intense reflections: 0.1249
• Weighted residual factors for all reflections included in the refinement: 0.1526
• Goodness-of-fit parameter for all reflections included in the refinement: 0.971
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes