Information card for entry 1562988

Structure parameters

• Formula: C32 H26 N2 S2 Zn
• Calculated formula: C32 N2 S2 Zn
• Title of publication: Co-assembly of Zn(SPh)2 and organic linkers into helical and zig-zag polymer chains
• Authors of publication: Liu, Yi; Yu, Ling-Min; Loo, Say Chye Joachim; Blair, Richard G.; Zhang, Qichun
• Journal of publication: Journal of Solid State Chemistry
• Year of publication: 2012
• Journal volume: 191
• Pages of publication: 283 - 286
• a: 8.6951 ± 0.0003 Å
• b: 10.7292 ± 0.0004 Å
• c: 30.1393 ± 0.001 Å
• α: 90°
• β: 96.711 ± 0.002°
• γ: 90°
• Cell volume: 2792.47 ± 0.17 ų
• Cell temperature: 273 ± 2 K
• Ambient diffraction temperature: 273 ± 2 K
• Number of distinct elements: 5
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/c 1
• Hall space group symbol: -P 2ybc
• Residual factor for all reflections: 0.0991
• Residual factor for significantly intense reflections: 0.0575
• Weighted residual factors for significantly intense reflections: 0.1622
• Weighted residual factors for all reflections included in the refinement: 0.1899
• Goodness-of-fit parameter for all reflections included in the refinement: 0.989
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No