Information card for entry 2224003

Structure parameters

• Chemical name: (<i>Z</i>)-4-Hexyl-1-(5-nitro-2-oxo-2,3-dihydro-1<i>H</i>-indol-3- ylidene)thiosemicarbazide
• Formula: C15 H19 N5 O3 S
• Calculated formula: C15 H19 N5 O3 S
• Title of publication: (<i>Z</i>)-4-Hexyl-1-(5-nitro-2-oxo-2,3-dihydro-1<i>H</i>-indol-3-ylidene)thiosemicarbazide
• Authors of publication: Pervez, Humayun; Yaqub, Muhammad; Manzoor, Nazia; Tahir, M. Nawaz; Iqbal, M. Saeed
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2009
• Journal volume: 65
• Journal issue: 11
• Pages of publication: o2698 - o2699
• a: 11.9464 ± 0.0006 Å
• b: 4.8845 ± 0.0003 Å
• c: 29.9688 ± 0.0017 Å
• α: 90°
• β: 101.131 ± 0.003°
• γ: 90°
• Cell volume: 1715.85 ± 0.17 ų
• Cell temperature: 296 ± 2 K
• Ambient diffraction temperature: 296 ± 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: 0.1415
• Residual factor for significantly intense reflections: 0.0544
• Weighted residual factors for significantly intense reflections: 0.1134
• Weighted residual factors for all reflections included in the refinement: 0.1434
• Goodness-of-fit parameter for all reflections included in the refinement: 1.003
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes