Information card for entry 7044823

Structure parameters

• Chemical name: cluster-1
• Formula: C87 H124 Br4 N8 O75.5 Sm8 Zn6
• Calculated formula: C87 H124 Br4 N8 O75.5 Sm8 Zn6
• Title of publication: Construction of luminescent high-nuclearity Zn-Ln rectangular nanoclusters with flexible long-chain Schiff base ligands.
• Authors of publication: Wang, Shiqing; Yang, Xiaoping; Zhu, Ting; Bo, Le; Wang, Ruihu; Huang, Shaoming; Wang, Chengri; Jiang, Dongmei; Chen, Hongfen; Jones, Richard A.
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2017
• Journal volume: 47
• Journal issue: 1
• Pages of publication: 53 - 57
• a: 14.4478 ± 0.0011 Å
• b: 14.9363 ± 0.0012 Å
• c: 20.1881 ± 0.0015 Å
• α: 69.789 ± 0.001°
• β: 76.115 ± 0.001°
• γ: 89.193 ± 0.001°
• Cell volume: 3957.5 ± 0.5 ų
• Cell temperature: 190 ± 1 K
• Ambient diffraction temperature: 190 ± 1 K
• Number of distinct elements: 7
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0779
• Residual factor for significantly intense reflections: 0.0507
• Weighted residual factors for significantly intense reflections: 0.1538
• Weighted residual factors for all reflections included in the refinement: 0.2141
• Goodness-of-fit parameter for all reflections included in the refinement: 1.074
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No