Information card for entry 7716964

Structure parameters

• Formula: C4 H12 K O4 P
• Calculated formula: C4 H10 K O4 P
• Title of publication: Facile room-temperature synthesis of layered transition metal phosphonates <i>via</i> hitherto unknown alkali metal <i>tert</i>-butyl phosphonates.
• Authors of publication: Kumar, Anuj; Ghatak, Aheli; Murugavel, Ramaswamy
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2024
• Journal volume: 53
• Journal issue: 34
• Pages of publication: 14399 - 14410
• a: 13.6615 ± 0.0006 Å
• b: 9.207 ± 0.0004 Å
• c: 7.0197 ± 0.0003 Å
• α: 90°
• β: 101.967 ± 0.004°
• γ: 90°
• Cell volume: 863.76 ± 0.07 ų
• Cell temperature: 100 K
• Ambient diffraction temperature: 100 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: 0.0841
• Residual factor for significantly intense reflections: 0.0815
• Weighted residual factors for significantly intense reflections: 0.2322
• Weighted residual factors for all reflections included in the refinement: 0.235
• Goodness-of-fit parameter for all reflections included in the refinement: 1.115
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No