Information card for entry 7718733

Structure parameters

• Formula: C4 H6 F6 Na2 O8 P2
• Calculated formula: C4 H6 F6 Na2 O8 P2
• Title of publication: Thermally labile mono-alkyl phosphates and their alkali metal derivatives: synthesis and solid-state supramolecular aggregation.
• Authors of publication: Kumar, Anuj; Murugavel, Ramaswamy
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2025
• Journal volume: 54
• Journal issue: 27
• Pages of publication: 10691 - 10709
• a: 14.599 ± 0.007 Å
• b: 6.622 ± 0.003 Å
• c: 13.912 ± 0.006 Å
• α: 90°
• β: 95.369 ± 0.012°
• γ: 90°
• Cell volume: 1339 ± 1.1 ų
• Cell temperature: 150 K
• Ambient diffraction temperature: 150 K
• Number of distinct elements: 6
• 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: 0.111
• Residual factor for significantly intense reflections: 0.0679
• Weighted residual factors for significantly intense reflections: 0.1734
• Weighted residual factors for all reflections included in the refinement: 0.2057
• Goodness-of-fit parameter for all reflections included in the refinement: 1.04
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No