Information card for entry 2311182

Structure parameters

• Chemical name: 2-(4-Bromophenyl)-1-pentyl-4,5-diphenyl-1<i>H</i>-imidazole
• Formula: C26 H25 Br N2
• Calculated formula: C26 H25 Br N2
• SMILES: Brc1ccc(c2n(c(c(n2)c2ccccc2)c2ccccc2)CCCCC)cc1
• Title of publication: 2-(4-Bromo-phen-yl)-1-pentyl-4,5-diphenyl-1H-imidazole.
• Authors of publication: Mohamed, Shaaban K.; Akkurt, Mehmet; Singh, Kuldip; Marzouk, Adel A.; Albayati, Mustafa R.
• Journal of publication: Acta crystallographica. Section E, Structure reports online
• Year of publication: 2013
• Journal volume: 69
• Journal issue: Pt 9
• Pages of publication: o1417
• a: 10.665 ± 0.005 Å
• b: 9.619 ± 0.005 Å
• c: 21.541 ± 0.01 Å
• α: 90°
• β: 91.092 ± 0.009°
• γ: 90°
• Cell volume: 2209.4 ± 1.9 ų
• Cell temperature: 150 ± 2 K
• Ambient diffraction temperature: 150 ± 2 K
• Number of distinct elements: 4
• 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: 0.1288
• Residual factor for significantly intense reflections: 0.0655
• Weighted residual factors for significantly intense reflections: 0.0979
• Weighted residual factors for all reflections included in the refinement: 0.1158
• Goodness-of-fit parameter for all reflections included in the refinement: 0.876
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No