Information card for entry 4085165

Structure parameters

• Formula: C28 H60 N5 Nd Si4
• Calculated formula: C28 H60 N5 Nd Si4
• SMILES: [c]12([cH]3[cH]4[c]5(C)[n]16CCN(CCn1c(ccc1C)C)[Nd]23456(N([Si](C)(C)C)[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C)C
• Title of publication: Synthesis, Characterization, and Reactivity of Lanthanide Amides Incorporating Neutral Pyrrole Ligand. Isolation and Characterization of Active Catalyst for Cyanosilylation of Ketones
• Authors of publication: Wang, Fenhua; Wei, Yun; Wang, Shaowu; Zhu, Xiancui; Zhou, Shuangliu; Yang, Gaosheng; Gu, Xiaoxia; Zhang, Guangchao; Mu, Xiaolong
• Journal of publication: Organometallics
• Year of publication: 2015
• Journal volume: 34
• Journal issue: 1
• Pages of publication: 86
• a: 8.9954 ± 0.0006 Å
• b: 12.0889 ± 0.0008 Å
• c: 17.6366 ± 0.0012 Å
• α: 85.34 ± 0.001°
• β: 83.709 ± 0.001°
• γ: 87.192 ± 0.001°
• Cell volume: 1898.5 ± 0.2 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 5
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0413
• Residual factor for significantly intense reflections: 0.0318
• Weighted residual factors for significantly intense reflections: 0.0752
• Weighted residual factors for all reflections included in the refinement: 0.0796
• Goodness-of-fit parameter for all reflections included in the refinement: 1.012
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No