Information card for entry 7041537

Structure parameters

• Formula: C42 H35 N3 O0 S4 Zn2
• Calculated formula: C42 H35 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: 10.0652 ± 0.0002 Å
• b: 16.2745 ± 0.0003 Å
• c: 23.4523 ± 0.0004 Å
• α: 90°
• β: 97.473 ± 0.001°
• γ: 90°
• Cell volume: 3809 ± 0.12 ų
• Cell temperature: 273 ± 2 K
• Ambient diffraction temperature: 273 ± 2 K
• Number of distinct elements: 6
• 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: 0.0636
• Residual factor for significantly intense reflections: 0.0334
• Weighted residual factors for significantly intense reflections: 0.0861
• Weighted residual factors for all reflections included in the refinement: 0.1027
• Goodness-of-fit parameter for all reflections included in the refinement: 1.016
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No