Information card for entry 7209805

Structure parameters

• Formula: C16 H26 Br2 Cu N2 O2 S2 Si
• Calculated formula: C16 H26 Br2 Cu N2 O2 S2 Si
• 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: 11.9456 ± 0.0001 Å
• b: 11.9456 ± 0.0001 Å
• c: 16.2905 ± 0.0004 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 2324.61 ± 0.06 ų
• Cell temperature: 173 ± 2 K
• Ambient diffraction temperature: 173 ± 2 K
• Number of distinct elements: 8
• Space group number: 76
• Hermann-Mauguin space group symbol: P 41
• Hall space group symbol: P 4w
• Residual factor for all reflections: 0.0736
• Residual factor for significantly intense reflections: 0.0585
• Weighted residual factors for significantly intense reflections: 0.1426
• Weighted residual factors for all reflections included in the refinement: 0.1613
• Goodness-of-fit parameter for all reflections included in the refinement: 0.999
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No