Information card for entry 2023548

Structure parameters

• Chemical name: 2-(Ethylsulfanyl)-3-(2-methylpropyl)-5,5-diphenyl-4,5-dihydro-3<i>H</i>-imidazol-4-one
• Formula: C21 H24 N2 O S
• Calculated formula: C21 H24 N2 O S
• Title of publication: Synthesis, crystal structure and Hirshfeld surface analysis of 2-(ethylsulfanyl)-3-(2-methylpropyl)-5,5-diphenyl-4,5-dihydro-3H-imidazol-4-one
• Authors of publication: El Moutaouakil Ala Allah, Abderrazzak; Massera, Chiara; Alsubari, Abdulsalam; Mague, Joel T.; Ramli, Youssef
• Journal of publication: Acta Crystallographica Section E Crystallographic Communications
• Year of publication: 2026
• Journal volume: 82
• Journal issue: 10
• a: 12.7849 ± 0.0004 Å
• b: 10.177 ± 0.0004 Å
• c: 14.4793 ± 0.0005 Å
• α: 90°
• β: 93.627 ± 0.001°
• γ: 90°
• Cell volume: 1880.16 ± 0.11 ų
• Cell temperature: 200 ± 2 K
• Ambient diffraction temperature: 200 ± 2 K
• Number of distinct elements: 5
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/n 1
• Hall space group symbol: -P 2yn
• Residual factor for all reflections: 0.065
• Residual factor for significantly intense reflections: 0.0492
• Weighted residual factors for significantly intense reflections: 0.1236
• Weighted residual factors for all reflections included in the refinement: 0.1342
• Goodness-of-fit parameter for all reflections included in the refinement: 1.053
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No