Information card for entry 7244835

Structure parameters

• Chemical name: Dinitro-(dimethyl 2,2'-bipyridine-4,4'-dicarboxylate)palladium(II)
• Formula: C14 H12 N4 O8 Pd
• Calculated formula: C14 H12 N4.001 O8.002 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: 8.5886 ± 0.0005 Å
• b: 7.8448 ± 0.0003 Å
• c: 24.9572 ± 0.0012 Å
• α: 90°
• β: 93.919 ± 0.004°
• γ: 90°
• Cell volume: 1677.58 ± 0.14 ų
• Cell temperature: 220 ± 2 K
• Ambient diffraction temperature: 220 ± 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: 0.0916
• Residual factor for significantly intense reflections: 0.0491
• Weighted residual factors for significantly intense reflections: 0.0791
• Weighted residual factors for all reflections included in the refinement: 0.0951
• Goodness-of-fit parameter for all reflections included in the refinement: 1.026
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No