Information card for entry 7209803

Structure parameters

• Formula: C28 H40 Br2 Cu N4 O2 S2 Si2
• Calculated formula: C28 H40 Br2 Cu N4 O2 S2 Si2
• Title of publication: Insight into the crystallization process: relationships between crystal structures and properties of copper(ii) coordination polymers containing dimethylbis(4-pyridyl)silane
• Authors of publication: Moon, So Yun; Noh, Tae Hwan; Jung, Ok-Sang
• Journal of publication: CrystEngComm
• Year of publication: 2013
• Journal volume: 15
• Journal issue: 19
• Pages of publication: 3854
• a: 12.1935 ± 0.0002 Å
• b: 20.2551 ± 0.0003 Å
• c: 15.1134 ± 0.0002 Å
• α: 90°
• β: 97.944 ± 0.001°
• γ: 90°
• Cell volume: 3696.9 ± 0.1 ų
• Cell temperature: 296 ± 2 K
• Ambient diffraction temperature: 296 ± 2 K
• Number of distinct elements: 8
• 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: 0.076
• Residual factor for significantly intense reflections: 0.0457
• Weighted residual factors for significantly intense reflections: 0.0976
• Weighted residual factors for all reflections included in the refinement: 0.1033
• Goodness-of-fit parameter for all reflections included in the refinement: 1.013
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No