Information card for entry 7106158

Structure parameters

• Formula: C68 H106 Cl2 N3 O18 S Tb
• Calculated formula: C68 H106 Cl2 N3 O18 S Tb
• Title of publication: A plug-and-play approach to the preparation of transparent luminescent hybrid materials based on poly(methyl methacrylate), a calix[4]arene crosslinking agent and terbium ions
• Authors of publication: Christopher R. Driscoll; Brodie L. Reid; Matthew J. McIldowie; Sara Muzzioli; Gareth L. Nealon; Brian W. Skelton; Stefano Stagni; David H. Brown; Massimiliano Massi; Mark I. Ogden
• Journal of publication: Chem.Commun.
• Year of publication: 2011
• Journal volume: 47
• Pages of publication: 3876
• a: 12.3105 ± 0.0017 Å
• b: 12.8395 ± 0.0016 Å
• c: 27.754 ± 0.003 Å
• α: 81.545 ± 0.01°
• β: 80.603 ± 0.01°
• γ: 61.86 ± 0.013°
• Cell volume: 3804 ± 0.9 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 7
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.1555
• Residual factor for significantly intense reflections: 0.0778
• Weighted residual factors for significantly intense reflections: 0.1749
• Weighted residual factors for all reflections included in the refinement: 0.2074
• Goodness-of-fit parameter for all reflections included in the refinement: 0.852
• Diffraction radiation wavelength: 1.54178 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No