Information card for entry 2311145

Structure parameters

• Chemical name: 2-(2,6-Dichlorophenyl)-1-pentyl-4,5-diphenyl-1<i>H</i>-imidazole
• Formula: C26 H24 Cl2 N2
• Calculated formula: C26 H24 Cl2 N2
• SMILES: Clc1c(c2n(c(c(n2)c2ccccc2)c2ccccc2)CCCCC)c(Cl)ccc1
• Title of publication: 2-(2,6-Di-chloro-phen-yl)-1-pentyl-4,5-diphenyl-1H-imidazole.
• Authors of publication: Akkurt, Mehmet; Mohamed, Shaaban K.; Singh, Kuldip; Marzouk, Adel A.; Abdelhamid, Antar A.
• Journal of publication: Acta crystallographica. Section E, Structure reports online
• Year of publication: 2013
• Journal volume: 69
• Journal issue: Pt 6
• Pages of publication: o846 - 7
• a: 20.172 ± 0.006 Å
• b: 15.947 ± 0.005 Å
• c: 14.5 ± 0.005 Å
• α: 90°
• β: 105.293 ± 0.007°
• γ: 90°
• Cell volume: 4499 ± 2 ų
• Cell temperature: 150 K
• Ambient diffraction temperature: 150 ± 2 K
• Number of distinct elements: 4
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/c 1
• Hall space group symbol: -P 2ybc
• Residual factor for all reflections: 0.1067
• Residual factor for significantly intense reflections: 0.054
• Weighted residual factors for significantly intense reflections: 0.0858
• Weighted residual factors for all reflections included in the refinement: 0.0981
• Goodness-of-fit parameter for all reflections included in the refinement: 0.842
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No