Information card for entry 1566697

Structure parameters

• Formula: C77 H129 As3 K Nd2 O6 Si8
• Calculated formula: C77 H129 As3 K Nd2 O6 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: 11.7764 ± 0.0013 Å
• b: 17.4676 ± 0.0014 Å
• c: 26.292 ± 0.004 Å
• α: 84.855 ± 0.009°
• β: 79.39 ± 0.009°
• γ: 71.581 ± 0.008°
• Cell volume: 5040.7 ± 1.1 ų
• Cell temperature: 150 K
• Ambient diffraction temperature: 150 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: 0.0735
• Residual factor for significantly intense reflections: 0.047
• Weighted residual factors for significantly intense reflections: 0.1053
• Weighted residual factors for all reflections included in the refinement: 0.1169
• Goodness-of-fit parameter for all reflections included in the refinement: 1.086
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No