Information card for entry 7046350

Structure parameters

• Formula: C56 H68 N6 Nd2 O36 Zn4
• Calculated formula: C56 H68 N6 Nd2 O36 Zn4
• Title of publication: Anion-induced 3d-4f luminescent coordination clusters: structural characteristics and chemical fixation of CO₂ under mild conditions.
• Authors of publication: Zhang, Ruilian; Wang, Li; Xu, Cong; Yang, Huan; Chen, Wanmin; Gao, Guoshu; Liu, Weisheng
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2018
• Journal volume: 47
• Journal issue: 21
• Pages of publication: 7159 - 7165
• a: 22.2896 ± 0.0005 Å
• b: 18.4936 ± 0.0005 Å
• c: 19.2391 ± 0.0004 Å
• α: 90°
• β: 99.957 ± 0.002°
• γ: 90°
• Cell volume: 7811.2 ± 0.3 ų
• Cell temperature: 173 ± 0.1 K
• Ambient diffraction temperature: 173 ± 0.1 K
• Number of distinct elements: 6
• Space group number: 15
• Hermann-Mauguin space group symbol: C 1 2/c 1
• Hall space group symbol: -C 2yc
• Residual factor for all reflections: 0.0591
• Residual factor for significantly intense reflections: 0.0452
• Weighted residual factors for significantly intense reflections: 0.1212
• Weighted residual factors for all reflections included in the refinement: 0.1348
• Goodness-of-fit parameter for all reflections included in the refinement: 1.106
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No