Information card for entry 7219095

Structure parameters

• Formula: C88 H148 N6 O9 Si4 Y2
• Calculated formula: C88 H148 N6 O9 Si4 Y2
• Title of publication: Carboxylation of terminal alkynes with CO2catalyzed by bis(amidate) rare-earth metal amides
• Authors of publication: Cheng, Hao; Zhao, Bei; Yao, Yingming; Lu, Chengrong
• Journal of publication: Green Chem.
• Year of publication: 2015
• Journal volume: 17
• Journal issue: 3
• Pages of publication: 1675
• a: 13.74 ± 0.02 Å
• b: 14 ± 0.04 Å
• c: 15.31 ± 0.03 Å
• α: 109.27 ± 0.07°
• β: 106.002 ± 0.004°
• γ: 98.57 ± 0.02°
• Cell volume: 2577 ± 10 ų
• Cell temperature: 223 ± 2 K
• Ambient diffraction temperature: 223 ± 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: 0.1288
• Residual factor for significantly intense reflections: 0.0897
• Weighted residual factors for significantly intense reflections: 0.2305
• Weighted residual factors for all reflections included in the refinement: 0.2559
• Goodness-of-fit parameter for all reflections included in the refinement: 1.06
• Diffraction radiation wavelength: 0.71075 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No