Information card for entry 7026757

Structure parameters

• Formula: C28 H38 Cu2 N2 O20 P6
• Calculated formula: C28 H38 Cu2 N2 O20 P6
• Title of publication: Supramolecular networks of polymethylphosphonic acid groups bonded to aromatic platforms: biphenyldiyl-2,2'-bis(methylphosphonic acid) and benzenetriyl-1,3,5-tris(methylphosphonic acid).
• Authors of publication: Zoń, Jerzy; Kong, Deyuan; Gagnon, Kevin; Perry, Houston; Holliness, LeAnthony; Clearfield, Abraham
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2010
• Journal volume: 39
• Journal issue: 45
• Pages of publication: 11008 - 11018
• a: 9.6376 ± 0.0003 Å
• b: 9.8817 ± 0.0003 Å
• c: 10.2276 ± 0.0003 Å
• α: 80.05 ± 0.001°
• β: 74.53 ± 0.001°
• γ: 87.55 ± 0.001°
• Cell volume: 924.62 ± 0.05 ų
• Cell temperature: 110 ± 2 K
• Ambient diffraction temperature: 110 ± 2 K
• Number of distinct elements: 6
• Space group number: 1
• Hermann-Mauguin space group symbol: P 1
• Hall space group symbol: P 1
• Residual factor for all reflections: 0.0343
• Residual factor for significantly intense reflections: 0.0324
• Weighted residual factors for significantly intense reflections: 0.0766
• Weighted residual factors for all reflections included in the refinement: 0.0779
• Goodness-of-fit parameter for all reflections included in the refinement: 1.033
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No