Information card for entry 7240767

Structure parameters

• Formula: C29 H45 N2 O8 Pr
• Calculated formula: C29 H45 N2 O8 Pr
• 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: 10.8462 ± 0.0004 Å
• b: 12.2567 ± 0.0004 Å
• c: 13.0356 ± 0.0004 Å
• α: 80.342 ± 0.003°
• β: 69.642 ± 0.003°
• γ: 84.833 ± 0.003°
• Cell volume: 1600.72 ± 0.1 ų
• Cell temperature: 110 ± 2 K
• Ambient diffraction temperature: 110 ± 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: 0.0312
• Residual factor for significantly intense reflections: 0.0237
• Weighted residual factors for significantly intense reflections: 0.0469
• Weighted residual factors for all reflections included in the refinement: 0.0484
• Goodness-of-fit parameter for all reflections included in the refinement: 1.046
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No