Information card for entry 7041538

Structure parameters

• Formula: C51 H41 N3 S4 Zn2
• Calculated formula: C51 H41 N3 S4 Zn2
• Title of publication: Multitopic ligand directed assembly of low-dimensional metal-chalcogenide organic frameworks.
• Authors of publication: Liu, Yi; Ye, Kaiqi; Wang, Yue; Zhang, Qichun; Bu, Xianhui; Feng, Pingyun
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2017
• Journal volume: 46
• Journal issue: 5
• Pages of publication: 1481 - 1486
• a: 16.1137 ± 0.0005 Å
• b: 15.1949 ± 0.0005 Å
• c: 18.2017 ± 0.0005 Å
• α: 90°
• β: 95.247 ± 0.002°
• γ: 90°
• Cell volume: 4437.9 ± 0.2 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 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: 0.0944
• Residual factor for significantly intense reflections: 0.0437
• Weighted residual factors for significantly intense reflections: 0.108
• Weighted residual factors for all reflections included in the refinement: 0.1168
• Goodness-of-fit parameter for all reflections included in the refinement: 1.043
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No