Information card for entry 7244821

Structure parameters

• Chemical name: Dinitro-(dimethyl 2,2'-bipyridine-4,4'-dicarboxylate)palladium(II)
• Formula: C14 H12 N4 O8 Pd
• Calculated formula: C14 H12 N4 O8 Pd
• Title of publication: Exploring the influence of polymorphism and chromophore co-ligands on linkage isomer photoswitching in [Pd(bpy4dca)(NO2)2]
• Authors of publication: Hatcher, Lauren E.; Coulson, Ben A.
• Journal of publication: CrystEngComm
• Year of publication: 2022
• a: 8.5713 ± 0.0005 Å
• b: 7.8306 ± 0.0004 Å
• c: 24.9557 ± 0.0013 Å
• α: 90°
• β: 93.877 ± 0.005°
• γ: 90°
• Cell volume: 1671.15 ± 0.16 ų
• Cell temperature: 199 ± 2 K
• Ambient diffraction temperature: 199 ± 2 K
• Number of distinct elements: 5
• 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: 0.0999
• Residual factor for significantly intense reflections: 0.0506
• Weighted residual factors for significantly intense reflections: 0.0887
• Weighted residual factors for all reflections included in the refinement: 0.1079
• Goodness-of-fit parameter for all reflections included in the refinement: 1.001
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No