Information card for entry 7042613

Structure parameters

• Formula: C Ba O4 P
• Calculated formula: C Ba O4 P
• Title of publication: Synthesis and characterization of new barium methylphosphonates.
• Authors of publication: Melánová, Klára; Beneš, Ludvík; Svoboda, Jan; Zima, Vítězslav; Vlček, Milan; Trchová, Miroslava
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2017
• Journal volume: 46
• Journal issue: 16
• Pages of publication: 5363 - 5372
• a: 20.5077 ± 0.0005 Å
• b: 7.21752 ± 0.00021 Å
• c: 7.49087 ± 0.00025 Å
• α: 90°
• β: 95.5216 ± 0.003°
• γ: 90°
• Cell volume: 1103.61 ± 0.06 ų
• Ambient diffraction temperature: 298 K
• Number of distinct elements: 4
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/c 1
• Hall space group symbol: -P 2ybc
• RFsqd: 0.10894
• Goodness-of-fit parameter for all reflections: 3.78
• Method of determination: powder diffraction
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 1.5405 Å
• Diffraction radiation type: CuKα~1~
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No