Information card for entry 4316714

Structure parameters

• Formula: C20 H30 B Cu N8 Se
• Calculated formula: C20 H30 B Cu N8 Se
• Title of publication: Probing the Antioxidant Action of Selenium and Sulfur Using Cu(I)-Chalcogenone Tris(pyrazolyl)methane and -borate Complexes
• Authors of publication: Martin M. Kimani; Julia L. Brumaghim; Don VanDerveer
• Journal of publication: Inorganic Chemistry
• Year of publication: 2010
• Journal volume: 49
• Pages of publication: 9200 - 9211
• a: 8.3319 ± 0.0017 Å
• b: 11.771 ± 0.002 Å
• c: 12.082 ± 0.002 Å
• α: 90°
• β: 92.09 ± 0.03°
• γ: 90°
• Cell volume: 1184.2 ± 0.4 ų
• Cell temperature: 168.15 K
• Ambient diffraction temperature: 168.15 K
• Number of distinct elements: 6
• Space group number: 11
• Hermann-Mauguin space group symbol: P 1 21/m 1
• Hall space group symbol: -P 2yb
• Residual factor for all reflections: 0.0465
• Residual factor for significantly intense reflections: 0.0383
• Weighted residual factors for significantly intense reflections: 0.0953
• Weighted residual factors for all reflections included in the refinement: 0.1021
• Goodness-of-fit parameter for all reflections included in the refinement: 1.059
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No