Information card for entry 4328915

Structure parameters

• Formula: C48 H156 As2 Cl6 Mn6 N12 O72 W18
• Calculated formula: C48 As2 Cl6 Mn6 N12 O72 W18
• Title of publication: Molecular Magnetism of M~6-Hexagon Ring in D~3d~-Symmetric [(MCl)~6~(XW~9~O~33~)~2~]^12-^ (M=Cu^II^ and Mn^II^, X=Sb^III^ and As^III^)
• Authors of publication: Toshihiro Yamase; Hirofumi Ishikawa; Hiroko Abe; Keisuke Fukaya; Hiroyuki Nojiri; Hideo Takeuchi
• Journal of publication: Inorganic Chemistry
• Year of publication: 2012
• Journal volume: 51
• Pages of publication: 4606 - 4619
• a: 20.12 ± 0.02 Å
• b: 20.12 ± 0.02 Å
• c: 27.43 ± 0.03 Å
• α: 90°
• β: 90°
• γ: 120°
• Cell volume: 9616 ± 17 ų
• Cell temperature: 173.1 K
• Number of distinct elements: 8
• Space group number: 148
• Hermann-Mauguin space group symbol: R -3 :H
• Hall space group symbol: -R 3
• Residual factor for significantly intense reflections: 0.023
• Weighted residual factors for all reflections included in the refinement: 0.051
• Goodness-of-fit parameter for all reflections included in the refinement: 1
• Diffraction radiation wavelength: 0.7107 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No