Information card for entry 7056438

Structure parameters

• Formula: C15 H26 La2 O22 P3 S3
• Calculated formula: C15 H15 La2 O22 P3 S3
• Title of publication: Synthesis of phosphonosulfonic acid building blocks as linkers for coordination polymers
• Authors of publication: Beyer, Ole; Homburg, Thomas; Albat, Martin; Stock, Norbert; Luening, Ulrich
• Journal of publication: New J. Chem.
• Year of publication: 2017
• Journal volume: 41
• Journal issue: 17
• Pages of publication: 8870 - 8876
• a: 20.047 ± 0.004 Å
• b: 11.357 ± 0.002 Å
• c: 18.677 ± 0.004 Å
• α: 90°
• β: 118.51 ± 0.03°
• γ: 90°
• Cell volume: 3736.6 ± 1.7 ų
• Cell temperature: 170 ± 2 K
• Ambient diffraction temperature: 170 ± 2 K
• Number of distinct elements: 6
• Space group number: 12
• Hermann-Mauguin space group symbol: C 1 2/m 1
• Hall space group symbol: -C 2y
• Residual factor for all reflections: 0.0724
• Residual factor for significantly intense reflections: 0.0667
• Weighted residual factors for significantly intense reflections: 0.1654
• Weighted residual factors for all reflections included in the refinement: 0.1685
• Goodness-of-fit parameter for all reflections included in the refinement: 1.004
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No