Information card for entry 1560433

Structure parameters

• Formula: C55 H69 N O19 Tb
• Calculated formula: C55 H69 N O19 Tb
• Title of publication: Structural and spectroscopic investigation of new luminescent hybrid materials based on calix[4]arene-tetracarboxylate and Ln 3+ ions (Ln = Gd, Tb or Eu)
• Authors of publication: Viana, R.S.; Oliveira, C.A.F.; Chojnacki, J.; Barros, B.S.; Alves-Jr, S.; Kulesza, J.
• Journal of publication: Journal of Solid State Chemistry
• Year of publication: 2017
• Journal volume: 251
• Pages of publication: 26 - 32
• a: 11.3359 ± 0.0004 Å
• b: 12.6499 ± 0.0004 Å
• c: 22.992 ± 0.0009 Å
• α: 86.976 ± 0.003°
• β: 83.813 ± 0.003°
• γ: 69.051 ± 0.003°
• Cell volume: 3060.8 ± 0.2 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 5
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0653
• Residual factor for significantly intense reflections: 0.0545
• Weighted residual factors for significantly intense reflections: 0.1394
• Weighted residual factors for all reflections included in the refinement: 0.151
• Goodness-of-fit parameter for all reflections included in the refinement: 1.074
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No