Information card for entry 4307367

Structure parameters

• Formula: C50 H114 I Mo6 N3 O24
• Calculated formula: C50 H114 I Mo6 N3 O24
• Title of publication: Protonation and Methylation of an Anderson-Type Polyoxoanion [IMo6O24]5-
• Authors of publication: Daisuke Honda; Shusaku Ikegami; Tomoaki Inoue; Tomoji Ozeki; Atsushi Yagasaki
• Journal of publication: Inorganic Chemistry
• Year of publication: 2007
• Journal volume: 46
• Pages of publication: 1464 - 1470
• a: 10.4009 ± 0.0001 Å
• b: 14.6658 ± 0.0003 Å
• c: 23.5395 ± 0.0004 Å
• α: 90°
• β: 100.324 ± 0.001°
• γ: 90°
• Cell volume: 3532.52 ± 0.1 ų
• Cell temperature: 83 ± 2 K
• Ambient diffraction temperature: 83 ± 2 K
• Number of distinct elements: 6
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/n 1
• Hall space group symbol: -P 2yn
• Residual factor for all reflections: 0.0393
• Residual factor for significantly intense reflections: 0.0343
• Weighted residual factors for significantly intense reflections: 0.0761
• Weighted residual factors for all reflections included in the refinement: 0.0791
• Goodness-of-fit parameter for all reflections included in the refinement: 1.199
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No