Information card for entry 1100201

Structure parameters

• Chemical name: (R,R)-p-Chlorophenyl-1-chloro-2-phenylethyl sulfoxide
• Formula: C14 H12 Cl2 O S
• Calculated formula: C14 H12 Cl2 O S
• Title of publication: Highly Enantiomerically Enriched α-Haloalkyl Grignard Reagents
• Authors of publication: Hoffmann, Reinhard W.; Nell, Peter G.; Leo, Roland; Harms, Klaus
• Journal of publication: Chemistry - A European Journal
• Year of publication: 2000
• Journal volume: 6
• Journal issue: 18
• Pages of publication: 3359 - 3365
• a: 9.018 ± 0.0006 Å
• b: 9.6771 ± 0.0008 Å
• c: 9.974 ± 0.0007 Å
• α: 71.564 ± 0.005°
• β: 62.985 ± 0.005°
• γ: 62.938 ± 0.005°
• Cell volume: 683.92 ų
• Ambient diffraction temperature: 213 K
• Number of distinct elements: 5
• Space group number: 1
• Hermann-Mauguin space group symbol: P 1
• Hall space group symbol: P 1
• Residual factor for significantly intense reflections: 4.37
• Weighted residual factors for significantly intense reflections: 4.37
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No