Information card for entry 7240766

Structure parameters

• Formula: C58 H90 N4 Nd2 O16
• Calculated formula: C58 H90 N4 Nd2 O16
• Title of publication: 2D-Metal-organic coordination polymers of lanthanides (La(III), Pr(III) and Nd(III)) with redox-active dioxolene bridging ligand
• Authors of publication: Kharitonov, Alexandr; Trofimova, Olesya Yur'evna; Meshcheryakova, Irina N.; Fukin, Georgii K.; Khrizanforov, Mikhail; Budnikova, Yulia H.; Bogomyakov, Artem Stepanovich; Aysin, Rinat R.; Kovalenko, Konstantin A.; Piskunov, Alexandr Vladimirovich
• Journal of publication: CrystEngComm
• Year of publication: 2020
• a: 10.8521 ± 0.0003 Å
• b: 12.2651 ± 0.0004 Å
• c: 13.0496 ± 0.0004 Å
• α: 79.711 ± 0.003°
• β: 69.4 ± 0.003°
• γ: 84.672 ± 0.003°
• Cell volume: 1598.87 ± 0.09 ų
• Cell temperature: 120 ± 2 K
• Ambient diffraction temperature: 120 ± 2 K
• Number of distinct elements: 5
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0467
• Residual factor for significantly intense reflections: 0.0343
• Weighted residual factors for significantly intense reflections: 0.0611
• Weighted residual factors for all reflections included in the refinement: 0.0634
• Goodness-of-fit parameter for all reflections included in the refinement: 0.999
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No