Information card for entry 7718738

Structure parameters

• Formula: C37 H69 B9 Cl4 N4 O2 Zn
• Calculated formula: C37 H69 B9 Cl4 N4 O2 Zn
• Title of publication: A comparative study on <i>nido</i>- and <i>closo</i>-carborane supported zinc-salen catalysts for the ROCOP of epoxides and anhydrides.
• Authors of publication: Xue, Jin-Bian; Wang, Jia-Ni; Chen, Ke-Cheng; Cheng, Qian; Zhang, Jia-Ying; Xiao, Xu-Qiong
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2025
• Journal volume: 54
• Journal issue: 21
• Pages of publication: 8400 - 8404
• a: 10.39 ± 0.006 Å
• b: 12.226 ± 0.007 Å
• c: 22.24 ± 0.013 Å
• α: 103.925 ± 0.012°
• β: 99.199 ± 0.012°
• γ: 97.975 ± 0.012°
• Cell volume: 2660 ± 3 ų
• Cell temperature: 296.15 K
• Ambient diffraction temperature: 296.15 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: 0.1441
• Residual factor for significantly intense reflections: 0.0642
• Weighted residual factors for significantly intense reflections: 0.1417
• Weighted residual factors for all reflections included in the refinement: 0.1737
• Goodness-of-fit parameter for all reflections included in the refinement: 0.96
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No