Information card for entry 4345338

Structure parameters

• Formula: C40 H54 B2 N12 S5 Y2
• Calculated formula: C40 H54 B2 N12 S5 Y2
• Title of publication: Facile Construction of Yttrium Pentasulfides from Yttrium Alkyl Precursors: Synthesis, Mechanism, and Reactivity.
• Authors of publication: Zhang, Fangjun; Zhang, Jie; Zhou, Xigeng
• Journal of publication: Inorganic chemistry
• Year of publication: 2017
• Journal volume: 56
• Journal issue: 4
• Pages of publication: 2070 - 2077
• a: 8.5206 ± 0.0012 Å
• b: 16.896 ± 0.002 Å
• c: 20.087 ± 0.003 Å
• α: 81.705 ± 0.002°
• β: 87.565 ± 0.002°
• γ: 86.122 ± 0.002°
• Cell volume: 2853.4 ± 0.7 ų
• Cell temperature: 173 ± 2 K
• Ambient diffraction temperature: 173 ± 2 K
• Number of distinct elements: 6
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.1239
• Residual factor for significantly intense reflections: 0.0713
• Weighted residual factors for significantly intense reflections: 0.1995
• Weighted residual factors for all reflections included in the refinement: 0.2284
• Goodness-of-fit parameter for all reflections included in the refinement: 0.924
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No