Information card for entry 7108653

Structure parameters

• Formula: C38 H70 Li N6 Si4 Y
• Calculated formula: C38 H70 Li N6 Si4 Y
• SMILES: c12c(cccc2)n([Y](n2cc(c3c2cccc3)C[NH]2C(C)(C)C)(N([Si](C)(C)C)[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C)cc1C[NH](C(C)(C)C)[Li]2
• Title of publication: Rare-earth metal complexes having an unusual indolyl-1,2-dianion through C‒H activation with a novel η1:(μ2‒η1:η1) bonding with metals
• Authors of publication: Zhu, Xiancui; Zhou, Shuangliu; Wang, Shaowu; Wei, Yun; Zhang, Lijun; Wang, Fenhua; Wang, Shaoyin; Feng, Zhijun
• Journal of publication: Chemical Communications (Cambridge, United Kingdom)
• Year of publication: 2012
• Journal volume: 48
• Journal issue: 98
• Pages of publication: 12020 - 12022
• a: 12.431 ± 0.002 Å
• b: 15.176 ± 0.003 Å
• c: 15.3466 ± 0.0017 Å
• α: 90°
• β: 124.166 ± 0.009°
• γ: 90°
• Cell volume: 2395.5 ± 0.7 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 6
• Space group number: 13
• Hermann-Mauguin space group symbol: P 1 2/c 1
• Hall space group symbol: -P 2yc
• Residual factor for all reflections: 0.1974
• Residual factor for significantly intense reflections: 0.062
• Weighted residual factors for significantly intense reflections: 0.087
• Weighted residual factors for all reflections included in the refinement: 0.1067
• Goodness-of-fit parameter for all reflections included in the refinement: 1.121
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No