Information card for entry 4317892

Structure parameters

• Formula: C12 H24 As2 Br6 Se4
• Calculated formula: C12 H24 As2 Br6 Se4
• SMILES: [As](Br)(Br)Br.[Se]1CCC[Se]CCC[Se]CCC[Se]CCC1.[As](Br)(Br)Br
• Title of publication: Arsenic(III) Halide Complexes with Acyclic and Macrocyclic Thio- and Selenoether Coligands: Synthesis and Structural Properties
• Authors of publication: Nicholas J. Hill; William Levason; Gillian Reid
• Journal of publication: Inorganic Chemistry
• Year of publication: 2002
• Journal volume: 41
• Pages of publication: 2070 - 2076
• a: 10.122 ± 0.0001 Å
• b: 13.4494 ± 0.0002 Å
• c: 10.5125 ± 0.0002 Å
• α: 90 ± 0.001°
• β: 113.49°
• γ: 90°
• Cell volume: 1312.52 ± 0.03 ų
• Cell temperature: 150 ± 1 K
• Ambient diffraction temperature: 150 ± 1 K
• Number of distinct elements: 5
• 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: 0.0722
• Residual factor for significantly intense reflections: 0.0656
• Weighted residual factors for significantly intense reflections: 0.1731
• Weighted residual factors for all reflections included in the refinement: 0.1816
• Goodness-of-fit parameter for all reflections included in the refinement: 1.053
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No