Information card for entry 2313019

Structure parameters

• Chemical name: (<i>Z</i>)-2-Fluorobenzyl 2-(5-fluoro-2-oxoindolin-3-ylidene)hydrazinecarbodithioate dimethyl sulfoxide monosolvate
• Formula: C18 H17 F2 N3 O2 S3
• Calculated formula: C18 H17 F2 N3 O2 S3
• Title of publication: Crystal structure of (<i>Z</i>)-2-fluoro-benzyl 2-(5-fluoro-2-oxoindolin-3-yl-idene)hydrazinecarbodi-thio-ate dimethyl sulfoxide monosolvate.
• Authors of publication: Abdul Manan, Mohd Abdul Fatah; Cordes, David B.; McKay, Aidan P.
• Journal of publication: Acta crystallographica. Section E, Crystallographic communications
• Year of publication: 2026
• Journal volume: 82
• Journal issue: Pt 7
• Pages of publication: 773 - 776
• a: 18.9344 ± 0.0011 Å
• b: 4.6861 ± 0.0003 Å
• c: 44.085 ± 0.002 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 3911.6 ± 0.4 ų
• Cell temperature: 100 ± 0.11 K
• Ambient diffraction temperature: 100 ± 0.11 K
• Number of distinct elements: 6
• Space group number: 33
• Hermann-Mauguin space group symbol: P n a 21
• Hall space group symbol: P 2c -2n
• Residual factor for all reflections: 0.1358
• Residual factor for significantly intense reflections: 0.107
• Weighted residual factors for significantly intense reflections: 0.2852
• Weighted residual factors for all reflections included in the refinement: 0.323
• Goodness-of-fit parameter for all reflections included in the refinement: 1.233
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 1.54184 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No