Information card for entry 7117548

Structure parameters

• Formula: C13 H8 F4 N2 O8 Sr
• Calculated formula: C13 H8 F4 N2 O8 Sr
• Title of publication: Metal-organic fireworks: MOFs as integrated structural scaffolds for pyrotechnic materials
• Authors of publication: L. H. Blair; A. Colakel; R. M. Vrcelj; I. Sinclair; S. J. Coles
• Journal of publication: Chem.Commun.
• Year of publication: 2015
• Journal volume: 51
• Pages of publication: 12185
• a: 7.3008 ± 0.0005 Å
• b: 9.1264 ± 0.0005 Å
• c: 13.1904 ± 0.0009 Å
• α: 101.118 ± 0.006°
• β: 93.83 ± 0.005°
• γ: 110.526 ± 0.006°
• Cell volume: 798.95 ± 0.1 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 6
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0605
• Residual factor for significantly intense reflections: 0.0574
• Weighted residual factors for significantly intense reflections: 0.1482
• Weighted residual factors for all reflections included in the refinement: 0.1525
• Goodness-of-fit parameter for all reflections included in the refinement: 1.036
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 0.71075 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No