Information card for entry 4306680

Structure parameters

• Formula: C96 H226 Mo30 N8 O103 P4
• Calculated formula: C96 H196 Mo30 N8 O103 P4
• Title of publication: An Approach to the Synthesis of Polyoxometalate Encapsulating Different Kinds of Oxoanions as Heteroions: Bisphosphitopyrophosphatotriacontamolybdate [(HPO3)2(P2O7)Mo30O90]8-
• Authors of publication: Sayuri Maeda; Takuya Goto; Masayo Takamoto; Kazuo Eda; Sadayuki Himeno; Hiroki Takahashi; Toshitaka Hori
• Journal of publication: Inorganic Chemistry
• Year of publication: 2008
• Journal volume: 47
• Pages of publication: 11197 - 11201
• a: 30.827 ± 0.002 Å
• b: 22.806 ± 0.0015 Å
• c: 30.928 ± 0.002 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 21744 ± 2 ų
• Cell temperature: 193 ± 2 K
• Ambient diffraction temperature: 193 ± 2 K
• Number of distinct elements: 6
• Space group number: 62
• Hermann-Mauguin space group symbol: P n m a
• Hall space group symbol: -P 2ac 2n
• Residual factor for all reflections: 0.2111
• Residual factor for significantly intense reflections: 0.1147
• Weighted residual factors for significantly intense reflections: 0.2305
• Weighted residual factors for all reflections included in the refinement: 0.2921
• Goodness-of-fit parameter for all reflections included in the refinement: 1.124
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No