Information card for entry 7102247

Structure parameters

• Formula: C94 H158 Al2 Li4 N4 O13 S2 Si2
• Calculated formula: C94 H158 Al2 Li4 N4 O13 S2 Si2
• Title of publication: Soluble, reactive and stable - unique aluminosilicate ligands and a heterobimetallic derivative [LAl(SLi)(micro-O)Si(OLi.2thf)(OtBu)2]2.
• Authors of publication: Jancik, Vojtech; Rascón-Cruz, Fernando; Cea-Olivares, Raymundo; Toscano, Rubén A
• Journal of publication: Chemical communications (Cambridge, England)
• Year of publication: 2007
• Journal issue: 43
• Pages of publication: 4528 - 4530
• a: 13.248 ± 0.002 Å
• b: 23.568 ± 0.004 Å
• c: 16.509 ± 0.002 Å
• α: 90°
• β: 100.91 ± 0.03°
• γ: 90°
• Cell volume: 5061.4 ± 1.3 ų
• Cell temperature: 173 ± 2 K
• Ambient diffraction temperature: 173 ± 2 K
• Number of distinct elements: 8
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/n 1
• Hall space group symbol: -P 2yn
• Residual factor for all reflections: 0.0882
• Residual factor for significantly intense reflections: 0.0539
• Weighted residual factors for significantly intense reflections: 0.1162
• Weighted residual factors for all reflections included in the refinement: 0.1304
• Goodness-of-fit parameter for all reflections included in the refinement: 1.013
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No