Information card for entry 4088662

Structure parameters

• Formula: C28 H36 B I N Nd O Si
• Calculated formula: C28 H36 B I N Nd O Si
• SMILES: [Nd]123456789(I)([O]%10CCCC%10)[c]%10([Si](C)(C)C%115[CH]6=[CH]7B([CH]8=[CH]9%11)N(CC)CC)[c]51cccc[c]25[c]13[c]4%10cccc1
• Title of publication: Synthesis and Structure of Silicon-Bridged Boratabenzene Fluorenyl Rare-Earth Metal Complexes
• Authors of publication: Wang, Chunhong; Xiang, Li; Leng, Xuebing; Chen, Yaofeng
• Journal of publication: Organometallics
• Year of publication: 2016
• Journal volume: 35
• Journal issue: 11
• Pages of publication: 1995
• a: 9.2648 ± 0.0016 Å
• b: 11.2797 ± 0.0019 Å
• c: 15.106 ± 0.003 Å
• α: 102.536 ± 0.002°
• β: 103.535 ± 0.002°
• γ: 108.87 ± 0.002°
• Cell volume: 1376.8 ± 0.4 ų
• Cell temperature: 173 ± 2 K
• Ambient diffraction temperature: 173.15 K
• Number of distinct elements: 8
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0276
• Residual factor for significantly intense reflections: 0.0255
• Weighted residual factors for significantly intense reflections: 0.0667
• Weighted residual factors for all reflections included in the refinement: 0.0683
• Goodness-of-fit parameter for all reflections included in the refinement: 1.019
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No