Information card for entry 4310160

Structure parameters

• Formula: C16 H16 As2 Cl2 S4
• Calculated formula: C16 H16 As2 Cl2 S4
• Title of publication: Synthesis and Characterization of Two Isomeric, Self-Assembled Arsenic-Thiolate Macrocycles
• Authors of publication: W. Jake Vickaryous; Elisabeth Rather Healey; Orion B. Berryman; Darren W. Johnson
• Journal of publication: Inorganic Chemistry
• Year of publication: 2005
• Journal volume: 44
• Pages of publication: 9247 - 9252
• a: 10.8881 ± 0.0008 Å
• b: 19.3511 ± 0.0014 Å
• c: 9.9524 ± 0.0007 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 2096.9 ± 0.3 ų
• Cell temperature: 153 ± 2 K
• Ambient diffraction temperature: 153 ± 2 K
• Number of distinct elements: 5
• Space group number: 62
• Hermann-Mauguin space group symbol: P n m a
• Hall space group symbol: -P 2ac 2n
• Residual factor for all reflections: 0.082
• Residual factor for significantly intense reflections: 0.0629
• Weighted residual factors for significantly intense reflections: 0.1582
• Weighted residual factors for all reflections included in the refinement: 0.169
• Goodness-of-fit parameter for all reflections included in the refinement: 1.166
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No