Information card for entry 2019849

Structure parameters

• Chemical name: (<i>Z</i>)-2-(1-Benzyl-2-oxoindolin-3-ylidene)-<i>N</i>-phenylhydrazine-1-carbothioamide
• Formula: C22 H18 N4 O S
• Calculated formula: C22 H18 N4 O S
• SMILES: c1ccccc1CN1c2ccccc2C(=N\NC(=S)Nc2ccccc2)\C1=O
• Title of publication: Crystal structure of (Z)-2-(1-benzyl-2-oxoindolin-3-ylidene)-N-phenylhydrazine-1-carbothioamide
• Authors of publication: Vimala, G.; Haribabu, J.; Karvembu, R.; Kumar, B. V. N. Phani; SubbiahPandi, A.
• Journal of publication: Acta Crystallographica Section E Crystallographic Communications
• Year of publication: 2015
• Journal volume: 71
• Journal issue: 3
• Pages of publication: o160
• a: 11.2426 ± 0.0003 Å
• b: 11.4899 ± 0.0003 Å
• c: 30.372 ± 0.0009 Å
• α: 79.121 ± 0.001°
• β: 88.628 ± 0.002°
• γ: 81.85 ± 0.001°
• Cell volume: 3813.91 ± 0.18 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 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: 0.167
• Residual factor for significantly intense reflections: 0.0525
• Weighted residual factors for significantly intense reflections: 0.1116
• Weighted residual factors for all reflections included in the refinement: 0.1556
• Goodness-of-fit parameter for all reflections included in the refinement: 0.986
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes