Information card for entry 2012858

Structure parameters

• Chemical name: Aquachlorobis(4,4',4''-tri-tert-butyl-2,2';6',2''-terpyridine- κ^3^N)terbium(III) diperchlorate ethanol disolvate
• Formula: C58 H84 Cl3 N6 O11 Tb
• Calculated formula: C57.98 H70 Cl3 N6 O10.99 Tb
• Title of publication: Aquachlorobis(4,4',4''-tri-<i>tert</i>-butyl-2,2';6',2''-terpyridine-κ^3^<i>N</i>)terbium(III) diperchlorate ethanol disolvate
• Authors of publication: Mürner, Hans-Ruedi; Scopelliti, Rosario; Bünzli, Jean-Claude G.
• Journal of publication: Acta Crystallographica Section C
• Year of publication: 2002
• Journal volume: 58
• Journal issue: 8
• Pages of publication: m434 - m435
• a: 14.392 ± 0.003 Å
• b: 21.233 ± 0.004 Å
• c: 22.172 ± 0.004 Å
• α: 90°
• β: 106.95 ± 0.03°
• γ: 90°
• Cell volume: 6481 ± 2 ų
• Cell temperature: 143 ± 2 K
• Ambient diffraction temperature: 143 ± 2 K
• Number of distinct elements: 6
• 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: 0.112
• Residual factor for significantly intense reflections: 0.065
• Weighted residual factors for significantly intense reflections: 0.177
• Weighted residual factors for all reflections included in the refinement: 0.203
• Goodness-of-fit parameter for all reflections included in the refinement: 0.965
• Diffraction radiation wavelength: 0.7107 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: Yes