Information card for entry 2023491

Structure parameters

• Chemical name: 1,1'-[Oxybis(ethane-2,1-diyl)]bis(2-methylsulfanyl-1<i>H</i>-benzo[<i>d</i>]imidazole)
• Formula: C20 H22 N4 O S2
• Calculated formula: C20 H22 N4 O S2
• Title of publication: Synthesis, crystal structure and Hirshfeld surface analysis of 1,1′-[oxybis(ethane-2,1-diyl)]bis(2-methylsulfanyl-1H-benzo[d]imidazole)
• Authors of publication: Moussaif, Ahmed; El Ghayati, Lhoussaine; Kalonji Mubengayi, Camille; Alsubari, Abdulsalam; Essassi, El Mokhtar; Mague, Joel T.; Ramli, Youssef
• Journal of publication: Acta Crystallographica Section E Crystallographic Communications
• Year of publication: 2025
• Journal volume: 81
• Journal issue: 6
• a: 10.6654 ± 0.0012 Å
• b: 13.5974 ± 0.0015 Å
• c: 15.7917 ± 0.0017 Å
• α: 109.206 ± 0.002°
• β: 101.687 ± 0.002°
• γ: 107.789 ± 0.002°
• Cell volume: 1938.8 ± 0.4 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 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: 0.1065
• Residual factor for significantly intense reflections: 0.0678
• Weighted residual factors for significantly intense reflections: 0.1873
• Weighted residual factors for all reflections included in the refinement: 0.1987
• Goodness-of-fit parameter for all reflections included in the refinement: 0.999
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No