Information card for entry 1557093

Structure parameters

• Formula: C52 H124 Gd2 K2 N4 O16 Si8
• Calculated formula: C52 H124 Gd2 K2 N4 O16 Si8
• Title of publication: The importance of the counter-cation in reductive rare-earth metal chemistry: 18-crown-6 instead of 2,2,2-cryptand allows isolation of [YII(NR2)3]1− and ynediolate and enediolate complexes from CO reactions
• Authors of publication: Ryan, Austin J.; Ziller, Joseph W.; Evans, William J.
• Journal of publication: Chemical Science
• Year of publication: 2020
• Journal volume: 11
• Journal issue: 7
• Pages of publication: 2006 - 2014
• a: 12.6614 ± 0.0013 Å
• b: 15.5498 ± 0.0015 Å
• c: 21.205 ± 0.002 Å
• α: 94.4758 ± 0.0013°
• β: 94.0831 ± 0.0013°
• γ: 105.746 ± 0.0012°
• Cell volume: 3987.4 ± 0.7 ų
• Cell temperature: 133 ± 2 K
• Ambient diffraction temperature: 133 ± 2 K
• Number of distinct elements: 7
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0538
• Residual factor for significantly intense reflections: 0.0332
• Weighted residual factors for significantly intense reflections: 0.0614
• Weighted residual factors for all reflections included in the refinement: 0.0672
• Goodness-of-fit parameter for all reflections included in the refinement: 0.989
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No