Information card for entry 2233194

Structure parameters

• Chemical name: <i>catena</i>-Poly[[bis(μ-2-formyl-6-methoxyphenolato- 1:2κ^4^<i>O</i>^1^,<i>O</i>^6^:<i>O</i>^1^,<i>O</i>^2^)copper(II)sodium]- μ-tetrafluoridoborate-1:1'κ^2^<i>F</i>:<i>F</i>']
• Formula: C16 H14 B Cu F4 Na O6
• Calculated formula: C16 H14 B Cu F4 Na O6
• SMILES: [B]([F-])(F)(F)F.c1([O]([Na]234)C)cccc5c1[O]2[Cu]1([O]=C5)[O]3c2c([O]4C)cccc2C=[O]1
• Title of publication: <i>catena</i>-Poly[[bis(μ-2-formyl-6-methoxyphenolato-1:2κ^4^<i>O</i>^1^,<i>O</i>^6^:<i>O</i>^1^,<i>O</i>^2^)copper(II)sodium]-μ-tetrafluoridoborate-1:1'κ^2^<i>F</i>:<i>F</i>']
• Authors of publication: Yang, Yu; Gao, Po; Yang, Jing-Lin; Hou, Hai-Ge; Gao, Ting
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2012
• Journal volume: 68
• Journal issue: 1
• Pages of publication: m37
• a: 9.932 ± 0.002 Å
• b: 19.349 ± 0.004 Å
• c: 9.94 ± 0.002 Å
• α: 90°
• β: 105.16 ± 0.03°
• γ: 90°
• Cell volume: 1843.7 ± 0.7 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 7
• 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: 0.1308
• Residual factor for significantly intense reflections: 0.0611
• Weighted residual factors for significantly intense reflections: 0.1196
• Weighted residual factors for all reflections included in the refinement: 0.1428
• Goodness-of-fit parameter for all reflections included in the refinement: 1.044
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: Yes