Information card for entry 4135032

Structure parameters

• Formula: C21 H17 B2 F8 N5 Pd
• Calculated formula: C21 H17 B2 F8 N5 Pd
• SMILES: [Pd]123[n]4c(c5cccc[n]15)cccc4N(c1cccc(c4cccc[n]34)[n]21)C.[B](F)(F)(F)[F-].[B](F)(F)(F)[F-]
• Title of publication: The self-assembly of a cyclometalated palladium photosensitizer into proteins-stabilized nanorods triggered drug uptake in vitro and in vivo.
• Authors of publication: Zhou, Xue-Quan; Xiao, Ming; Vadde, Ramu; Hilgendorf, Jonathan; Li, Xuezhao; Papadopoulou, Panagiota; Siegler, Maxime A.; Kros, Alexander; Sun, Wen; Bonnet, Sylvestre
• Journal of publication: Journal of the American Chemical Society
• Year of publication: 2020
• a: 8.7303 ± 0.0003 Å
• b: 9.6154 ± 0.0003 Å
• c: 13.7013 ± 0.0005 Å
• α: 77.129 ± 0.003°
• β: 76.604 ± 0.003°
• γ: 83.396 ± 0.003°
• Cell volume: 1088.31 ± 0.07 ų
• Cell temperature: 110 ± 2 K
• Ambient diffraction temperature: 110 ± 2 K
• Number of distinct elements: 6
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0449
• Residual factor for significantly intense reflections: 0.0343
• Weighted residual factors for significantly intense reflections: 0.0666
• Weighted residual factors for all reflections included in the refinement: 0.0709
• Goodness-of-fit parameter for all reflections included in the refinement: 1.062
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No