Information card for entry 7705299

Structure parameters

• Formula: C31 H23 N O2 Pd
• Calculated formula: C31 H23 N O2 Pd
• Title of publication: Fluorescent perylenylpyridine complexes: an experimental and theoretical study.
• Authors of publication: Expósito, J Emilio; Aullón, Gabriel; Bardají, Manuel; Miguel, Jesús A; Espinet, Pablo
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2020
• Journal volume: 49
• Journal issue: 38
• Pages of publication: 13326 - 13338
• a: 7.9934 ± 0.0003 Å
• b: 15.8415 ± 0.0008 Å
• c: 18.4651 ± 0.0007 Å
• α: 90°
• β: 100.105 ± 0.004°
• γ: 90°
• Cell volume: 2301.92 ± 0.17 ų
• Cell temperature: 293 K
• Ambient diffraction temperature: 293 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: 0.1089
• Residual factor for significantly intense reflections: 0.0491
• Weighted residual factors for significantly intense reflections: 0.072
• Weighted residual factors for all reflections included in the refinement: 0.0903
• Goodness-of-fit parameter for all reflections included in the refinement: 0.998
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No