Information card for entry 7033829

Structure parameters

• Formula: C56 H76 K2 La2 N16 O42 S4
• Calculated formula: C56 H76 K2 La2 N16 O42 S4
• Title of publication: Lanthanide derivatives comprising arylhydrazones of β-diketones: cooperative E/Z isomerization and catalytic activity in nitroaldol reaction.
• Authors of publication: Mahmudov, Kamran T.; Guedes da Silva, M Fátima C; Sutradhar, Manas; Kopylovich, Maximilian N.; Huseynov, Fatali E.; Shamilov, Nazim T.; Voronina, Anna A.; Buslaeva, Tatyana M.; Pombeiro, Armando J. L.
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2015
• Journal volume: 44
• Journal issue: 12
• Pages of publication: 5602 - 5610
• a: 35.033 ± 0.005 Å
• b: 12.727 ± 0.006 Å
• c: 25.692 ± 0.005 Å
• α: 90°
• β: 109.914 ± 0.005°
• γ: 90°
• Cell volume: 10770 ± 6 ų
• Cell temperature: 296 ± 2 K
• Ambient diffraction temperature: 296 ± 2 K
• Number of distinct elements: 7
• 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: 0.2057
• Residual factor for significantly intense reflections: 0.0902
• Weighted residual factors for significantly intense reflections: 0.2058
• Weighted residual factors for all reflections included in the refinement: 0.242
• Goodness-of-fit parameter for all reflections included in the refinement: 0.879
• Diffraction radiation wavelength: 0.71069 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No