Information card for entry 4306980

Structure parameters

• Chemical name: catena-tetrakis(N,N'-pyrimidin-2-olate)-biscopper(ii)-tallium nitrate- -methanol solvate
• Formula: C8.5 H8 Cu N4.5 O4 Tl0.5
• Calculated formula: C8.5 H6 Cu N4.408 O3.724 Tl0.408
• Title of publication: Structural and Magnetic Properties of Layered Copper(II) Coordination Polymers Intercalating s and f Metal Ions
• Authors of publication: Jorge A. R. Navarro; Elisa Barea; Juan M. Salas; Norberto Masciocchi; Simona Galli; Angelo Sironi
• Journal of publication: Inorganic Chemistry
• Year of publication: 2007
• Journal volume: 46
• Pages of publication: 2988 - 2997
• a: 19.044 ± 0.002 Å
• b: 11.037 ± 0.001 Å
• c: 11.451 ± 0.003 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 2406.9 ± 0.7 ų
• Cell temperature: 298 ± 2 K
• Ambient diffraction temperature: 298 ± 2 K
• Number of distinct elements: 6
• Space group number: 62
• Hermann-Mauguin space group symbol: P n a m
• Hall space group symbol: -P 2c 2n
• Residual factor for all reflections: 0.1019
• Residual factor for significantly intense reflections: 0.0622
• Weighted residual factors for significantly intense reflections: 0.1423
• Weighted residual factors for all reflections included in the refinement: 0.1622
• Goodness-of-fit parameter for all reflections included in the refinement: 1.073
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No