Information card for entry 7718784

Structure parameters

• Formula: C38 H66.5 Fe2 Mg N3.5 O14
• Calculated formula: C38 H66.5 Fe2 Mg N3.5 O14
• Title of publication: Trinuclear [FeIII2-Mg^II] compounds with aminopyridines as precursors for supported CC bond hydrogenation catalysts at atmospheric pressure in a plug-flow reactor.
• Authors of publication: Koshenskova, Kseniya A.; Tigai, Yana A.; Nebykov, Denis N.; Lagutina, Anastasia V.; Mokhov, Vladimir M.; Dolgushin, Fedor M.; Razvorotneva, Lada S.; Efimov, Nikolay N.; Babeshkin, Konstantin A.; Gogoleva, Natalia V.; Imshennik, Vladimir K.; Novichikhin, Sergey V.; Eremenko, Igor L.; Lutsenko, Irina A.
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2025
• Journal volume: 54
• Journal issue: 23
• Pages of publication: 9329 - 9337
• a: 13.358 ± 0.004 Å
• b: 28.564 ± 0.008 Å
• c: 13.605 ± 0.004 Å
• α: 90°
• β: 101.078 ± 0.01°
• γ: 90°
• Cell volume: 5094 ± 3 ų
• Cell temperature: 100 K
• Ambient diffraction temperature: 100 K
• Number of distinct elements: 6
• 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: 0.0689
• Residual factor for significantly intense reflections: 0.0506
• Weighted residual factors for significantly intense reflections: 0.1101
• Weighted residual factors for all reflections included in the refinement: 0.1187
• Goodness-of-fit parameter for all reflections included in the refinement: 1.045
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No