Information card for entry 4307364

Structure parameters

• Formula: C54 H124 I Mo6 N5 O26
• Calculated formula: C54 H124 I Mo6 N5 O26
• 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: 17.6105 ± 0.0004 Å
• b: 15.5432 ± 0.0005 Å
• c: 29.3316 ± 0.0009 Å
• α: 90°
• β: 91.475 ± 0.003°
• γ: 90°
• Cell volume: 8026.1 ± 0.4 ų
• Cell temperature: 120 ± 2 K
• Ambient diffraction temperature: 120 ± 2 K
• Number of distinct elements: 6
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/a 1
• Hall space group symbol: -P 2yab
• Residual factor for all reflections: 0.0937
• Residual factor for significantly intense reflections: 0.0588
• Weighted residual factors for significantly intense reflections: 0.1708
• Weighted residual factors for all reflections included in the refinement: 0.1842
• Goodness-of-fit parameter for all reflections included in the refinement: 1.004
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No