Information card for entry 2215423

Structure parameters

• Chemical name: 3-Bromo-1-(2,4-dichlorophenyl)-2-methoxy-3-(4-methoxyphenyl)propan-1-one–\ 2-bromo-3-(3-chloro-4-methoxyphenyl)-1-(4-chlorophenyl)-3-methoxypropan-1-one (0.91/0.09)
• Formula: C17 H15 Br Cl2 O3
• Calculated formula: C17 H15 Br Cl2 O3
• Title of publication: 3-Bromo-1-(2,4-dichlorophenyl)-2-methoxy-3-(4-methoxyphenyl)propan-1-one–2-bromo-3-(3-chloro-4-methoxyphenyl)-1-(4-chlorophenyl)-3-methoxypropan-1-one (0.91/0.09)
• Authors of publication: Butcher, Ray J.; Jasinski, Jerry P.; Narayana, B.; Mayekar, Anil N.; Yathirajan, H. S.
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2007
• Journal volume: 63
• Journal issue: 10
• Pages of publication: o4123 - o4124
• a: 7.8013 ± 0.0012 Å
• b: 11.19 ± 0.002 Å
• c: 11.438 ± 0.003 Å
• α: 113.88 ± 0.02°
• β: 98.649 ± 0.016°
• γ: 95.991 ± 0.014°
• Cell volume: 887.4 ± 0.4 ų
• Cell temperature: 296 K
• Ambient diffraction temperature: 296 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: 0.1263
• Residual factor for significantly intense reflections: 0.0476
• Weighted residual factors for significantly intense reflections: 0.1182
• Weighted residual factors for all reflections included in the refinement: 0.1556
• Goodness-of-fit parameter for all reflections included in the refinement: 1.078
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: Yes