Information card for entry 4305596

Structure parameters

• Formula: C12 H44 F2 Mo8 N4 Na2 O30
• Calculated formula: C12 H44 F2 Mo8 N4 Na2 O30
• Title of publication: Synthetic Approaches for Noncentrosymmetric Molybdates
• Authors of publication: Desmond J. Hubbard; Alexander R. Johnston; Hernan Sanchez Casalongue; Amy Narducci Sarjeant; Alexander J. Norquist
• Journal of publication: Inorganic Chemistry
• Year of publication: 2008
• Journal volume: 47
• Pages of publication: 8518 - 8525
• a: 11.4789 ± 0.0004 Å
• b: 15.9713 ± 0.0004 Å
• c: 11.9427 ± 0.0004 Å
• α: 90°
• β: 113.59 ± 0.004°
• γ: 90°
• Cell volume: 2006.52 ± 0.13 ų
• Cell temperature: 110 K
• Ambient diffraction temperature: 110 K
• Number of distinct elements: 7
• 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: 0.034
• Residual factor for significantly intense reflections: 0.0227
• Weighted residual factors for all reflections: 0.0687
• Weighted residual factors for significantly intense reflections: 0.056
• Weighted residual factors for all reflections included in the refinement: 0.056
• Goodness-of-fit parameter for all reflections included in the refinement: 0.8848
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No