Information card for entry 7053492

Structure parameters

• Formula: C44 H92 Li6 N8 O6
• Calculated formula: C44 H92 Li6 N8 O6
• Title of publication: Homo- and heteroanionic alkali metal aza-enolate aggregates derived from o-methylvalerolactim ether
• Authors of publication: Andrews, Philip C.; Bull, Steven D.; Koutsaplis, Magdaline
• Journal of publication: New Journal of Chemistry
• Year of publication: 2010
• Journal volume: 34
• Journal issue: 8
• Pages of publication: 1678
• a: 20.235 ± 0.004 Å
• b: 15.067 ± 0.003 Å
• c: 18.853 ± 0.004 Å
• α: 90°
• β: 109.41 ± 0.03°
• γ: 90°
• Cell volume: 5421 ± 2 ų
• Cell temperature: 123 ± 2 K
• Ambient diffraction temperature: 123 ± 2 K
• Number of distinct elements: 5
• Space group number: 15
• Hermann-Mauguin space group symbol: C 1 2/c 1
• Hall space group symbol: -C 2yc
• Residual factor for all reflections: 0.0787
• Residual factor for significantly intense reflections: 0.0519
• Weighted residual factors for significantly intense reflections: 0.129
• Weighted residual factors for all reflections included in the refinement: 0.146
• Goodness-of-fit parameter for all reflections included in the refinement: 1.036
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No