Information card for entry 7718065

Structure parameters

• Formula: Cs3 K Mo5 O22 P2
• Calculated formula: Cs3 K Mo5 O22 P2
• Title of publication: Four noncentrosymmetric molybdophosphates discovered by a chemical substitution strategy.
• Authors of publication: Gao, Zhixia; Li, Ke; Du, Hong; Baiheti, Tuohetijiang
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2025
• Journal volume: 54
• Journal issue: 10
• Pages of publication: 4025 - 4029
• a: 6.5727 ± 0.0011 Å
• b: 19.456 ± 0.002 Å
• c: 17.865 ± 0.003 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 2284.5 ± 0.6 ų
• Cell temperature: 296 ± 2 K
• Ambient diffraction temperature: 296 K
• Number of distinct elements: 5
• Space group number: 20
• Hermann-Mauguin space group symbol: C 2 2 21
• Hall space group symbol: C 2c 2
• Residual factor for all reflections: 0.0669
• Residual factor for significantly intense reflections: 0.0543
• Weighted residual factors for significantly intense reflections: 0.1105
• Weighted residual factors for all reflections included in the refinement: 0.125
• Goodness-of-fit parameter for all reflections included in the refinement: 1.051
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No