Information card for entry 1566700

Structure parameters

• Formula: C74 H138 As14 K2 Nd2 O12 Si8
• Calculated formula: C74 H138 As14 K2 Nd2 O12 Si8
• Title of publication: From a nanoparticular solid-state material to molecular organo-f-element-polyarsenides
• Authors of publication: Reinfandt, Niklas; Hauser, Adrian; Münzfeld, Luca; Roesky, Peter W.
• Journal of publication: Chemical Science
• Year of publication: 2022
• a: 41.591 ± 0.0016 Å
• b: 13.2497 ± 0.0004 Å
• c: 19.5306 ± 0.0008 Å
• α: 90°
• β: 95.516 ± 0.003°
• γ: 90°
• Cell volume: 10712.9 ± 0.7 ų
• Cell temperature: 100 K
• Ambient diffraction temperature: 100 K
• Number of distinct elements: 7
• 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: 0.1043
• Residual factor for significantly intense reflections: 0.0535
• Weighted residual factors for significantly intense reflections: 0.1136
• Weighted residual factors for all reflections included in the refinement: 0.1332
• Goodness-of-fit parameter for all reflections included in the refinement: 1.024
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No