Information card for entry 2017243

Structure parameters

• Common name: 2,2'-Diselenodibenzyl chloride
• Chemical name: bis[2-(chloromethyl)phenyl] diselenide
• Formula: C14 H12 Cl2 Se2
• Calculated formula: C14 H12 Cl2 Se2
• SMILES: [Se]([Se]c1ccccc1CCl)c1ccccc1CCl
• Title of publication: Similarities and differences between bis[2-(bromomethyl)phenyl] diselenide, bis[2-(chloromethyl)phenyl] diselenide and bis[2-(hydroxymethyl)phenyl] diselenide
• Authors of publication: Lari, Alberth; Rominger, Frank; Gleiter, Rolf
• Journal of publication: Acta Crystallographica Section C
• Year of publication: 2009
• Journal volume: 65
• Journal issue: 8
• Pages of publication: o400 - o403
• a: 7.916 ± 0.0002 Å
• b: 8.0215 ± 0.0001 Å
• c: 23.4689 ± 0.0004 Å
• α: 98.388 ± 0.001°
• β: 95.287 ± 0.001°
• γ: 90.61 ± 0.001°
• Cell volume: 1467.58 ± 0.05 ų
• Cell temperature: 200 ± 2 K
• Ambient diffraction temperature: 200 ± 2 K
• Number of distinct elements: 4
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0936
• Residual factor for significantly intense reflections: 0.0501
• Weighted residual factors for significantly intense reflections: 0.0854
• Weighted residual factors for all reflections included in the refinement: 0.0998
• Goodness-of-fit parameter for all reflections included in the refinement: 1.042
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes