Information card for entry 7052049

Structure parameters

• Formula: C36 H40 Mo8 N6 O26
• Calculated formula: C36 H40 Mo8 N6 O26
• Title of publication: Sequential transformations in assemblies based on octamolybdate clusters and 1,2-bis(4-pyridyl)ethane
• Authors of publication: Reinaldo Atencio; Alexander Briceño; Pedro Silva; José A. Rodríguez; Jonathan C. Hanson
• Journal of publication: New Journal of Chemistry
• Year of publication: 2007
• Journal volume: 31
• Journal issue: 1
• Pages of publication: 33
• a: 11.581 ± 0.003 Å
• b: 17.146 ± 0.007 Å
• c: 12.875 ± 0.003 Å
• α: 90°
• β: 101.447 ± 0.016°
• γ: 90°
• Cell volume: 2505.7 ± 1.4 ų
• Cell temperature: 298 ± 2 K
• Ambient diffraction temperature: 298 ± 2 K
• Number of distinct elements: 5
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/c 1
• Hall space group symbol: -P 2ybc
• Residual factor for all reflections: 0.082
• Residual factor for significantly intense reflections: 0.0426
• Weighted residual factors for significantly intense reflections: 0.088
• Weighted residual factors for all reflections included in the refinement: 0.103
• Goodness-of-fit parameter for all reflections included in the refinement: 1.041
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No