Information card for entry 7715565

Structure parameters

• Formula: C43 H37 Cl O P2 Ru
• Calculated formula: C43 H37 Cl O P2 Ru
• SMILES: [Ru]1234([P](c5ccccc5)(c5ccccc5)c5ccccc5)([P](c5ccccc5)(c5ccccc5)c5ccccc5)(Cl)[cH]5[cH]2[c]1([cH]3[cH]45)C(=O)C
• Title of publication: Dual FGFR-targeting and pH-activatable ruthenium-peptide conjugates for targeted therapy of breast cancer.
• Authors of publication: Franco Machado, João; Sá, Marco; Pires, Inês; da Silva, Miguel Tarita; Marques, Fernanda; Coelho, Jaime A. S.; Mendes, Filipa; Piedade, M Fátima M; Machuqueiro, Miguel; Jiménez, María Angeles; Garcia, Maria Helena; Correia, João D G; Morais, Tânia S
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2024
• Journal volume: 53
• Journal issue: 18
• Pages of publication: 7682 - 7693
• a: 10.5179 ± 0.0003 Å
• b: 11.2268 ± 0.0004 Å
• c: 19.1391 ± 0.0007 Å
• α: 85.061 ± 0.001°
• β: 75.264 ± 0.001°
• γ: 63.177 ± 0.001°
• Cell volume: 1949.41 ± 0.12 ų
• Cell temperature: 298 ± 2 K
• Ambient diffraction temperature: 298 ± 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: 0.046
• Residual factor for significantly intense reflections: 0.0393
• Weighted residual factors for significantly intense reflections: 0.128
• Weighted residual factors for all reflections included in the refinement: 0.1344
• Goodness-of-fit parameter for all reflections included in the refinement: 0.936
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No