Information card for entry 4344751

Structure parameters

• Formula: Ba Cu4 O17 P4 Ti
• Calculated formula: Ba Cu4 O17 P4 Ti
• Title of publication: A(2+) Cation Control of Chiral Domain Formation in A(TiO)Cu4(PO4)4 (A = Ba, Sr).
• Authors of publication: Kimura, Kenta; Sera, Masakazu; Kimura, Tsuyoshi
• Journal of publication: Inorganic chemistry
• Year of publication: 2016
• Journal volume: 55
• Journal issue: 3
• Pages of publication: 1002 - 1004
• a: 9.6028 ± 0.0005 Å
• b: 9.6028 ± 0.0005 Å
• c: 7.1209 ± 0.0005 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 656.65 ± 0.07 ų
• Cell temperature: 294.1 K
• Ambient diffraction temperature: 294.1 K
• Number of distinct elements: 5
• Space group number: 90
• Hermann-Mauguin space group symbol: P 4 21 2
• Hall space group symbol: P 4ab 2ab
• Residual factor for significantly intense reflections: 0.0398
• Weighted residual factors for all reflections included in the refinement: 0.0523
• Goodness-of-fit parameter for all reflections included in the refinement: 1.035
• Diffraction radiation wavelength: 0.71075 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No