Information card for entry 4315715

Structure parameters

• Common name: [Gd((S,S)-tBu-pbxa)2](NO3)3
• Formula: C42 H60 Gd N13 O18
• Calculated formula: C42 H58 Gd N13 O18
• Title of publication: A Chiral 2,6-Bis(Oxazolinyl)Pyridine Ligand with Amide Groups to Form Isomorphous Complexes through All the Lanthanoid Series
• Authors of publication: Kenji Matsumoto; Keita Suzuki; Toshiaki Tsukuda; Taro Tsubomura
• Journal of publication: Inorganic Chemistry
• Year of publication: 2010
• Journal volume: 49
• Pages of publication: 4717 - 4719
• a: 21.394 ± 0.013 Å
• b: 12.674 ± 0.008 Å
• c: 10.872 ± 0.007 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 2948 ± 3 ų
• Cell temperature: 123.1 K
• Ambient diffraction temperature: 123.1 K
• Number of distinct elements: 5
• Space group number: 18
• Hermann-Mauguin space group symbol: P 21 21 2
• Hall space group symbol: P 2 2ab
• Residual factor for significantly intense reflections: 0.0481
• Weighted residual factors for all reflections included in the refinement: 0.149
• Goodness-of-fit parameter for all reflections included in the refinement: 1.127
• Diffraction radiation wavelength: 0.7107 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No