Information card for entry 4308091

Structure parameters

• Formula: C43 H81 Mo6 N3 O18
• Calculated formula: C42.996 H81 Mo6 N3 O18
• Title of publication: Naphthylimido-Substituted Hexamolybdate: Preparation, Crystal Structures, Solvent Effects, and Optical Properties of Three Polymorphs
• Authors of publication: Jian Hao; Laurent Ruhlmann; Yulin Zhu; Qiang Li; Yongge Wei
• Journal of publication: Inorganic Chemistry
• Year of publication: 2007
• Journal volume: 46
• Pages of publication: 4960 - 4967
• a: 12.957 ± 0.003 Å
• b: 20.993 ± 0.004 Å
• c: 20.87 ± 0.004 Å
• α: 90°
• β: 95.27 ± 0.03°
• γ: 90°
• Cell volume: 5653 ± 2 ų
• Cell temperature: 288 ± 2 K
• Ambient diffraction temperature: 288 ± 2 K
• Number of distinct elements: 5
• 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: 0.0463
• Residual factor for significantly intense reflections: 0.0309
• Weighted residual factors for significantly intense reflections: 0.072
• Weighted residual factors for all reflections included in the refinement: 0.0781
• Goodness-of-fit parameter for all reflections included in the refinement: 1.037
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No