Information card for entry 2242067

Structure parameters

• Chemical name: Aquanitratobis[1,1,1-tris(hydroxymethyl)propane]terbium(III) dinitrate
• Formula: C12 H30 N3 O16 Tb
• Calculated formula: C12 H30 N3 O16 Tb
• Title of publication: Crystal structures of two mononuclear complexes of terbium(III) nitrate with the tripodal alcohol 1,1,1-tris(hydroxymethyl)propane
• Authors of publication: Gregório, Thaiane; Giese, Siddhartha O. K.; Nunes, Giovana G.; Soares, Jaísa F.; Hughes, David L.
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2017
• Journal volume: 73
• Journal issue: 2
• Pages of publication: 278 - 285
• a: 9.144 ± 0.0006 Å
• b: 12.787 ± 0.0007 Å
• c: 19.7151 ± 0.0012 Å
• α: 90°
• β: 101.796 ± 0.002°
• γ: 90°
• Cell volume: 2256.5 ± 0.2 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 5
• 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: 0.0123
• Residual factor for significantly intense reflections: 0.012
• Weighted residual factors for significantly intense reflections: 0.0292
• Weighted residual factors for all reflections included in the refinement: 0.0294
• Goodness-of-fit parameter for all reflections included in the refinement: 1.127
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: Yes