Information card for entry 1100997

Structure parameters

• Formula: C28 Mo36 N8 O160
• Calculated formula: C28 Mo36 N8 O160
• Authors of publication: Kazuo Eda; Yuichi Iriki
• Journal of publication: Chemistry Letters
• a: 15.445 ± 0.004 Å
• b: 17.21 ± 0.004 Å
• c: 18.456 ± 0.005 Å
• α: 63.653 ± 0.004°
• β: 67.259 ± 0.004°
• γ: 80.343 ± 0.004°
• Cell volume: 4054.3 ± 1.7 ų
• Cell temperature: 193 ± 2 K
• Ambient diffraction temperature: 193 ± 2 K
• Number of distinct elements: 4
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0794
• Residual factor for significantly intense reflections: 0.0658
• Weighted residual factors for significantly intense reflections: 0.1539
• Weighted residual factors for all reflections included in the refinement: 0.1612
• Goodness-of-fit parameter for all reflections included in the refinement: 1.07
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Duplicate of: 8000016
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No