Information card for entry 7710634

Structure parameters

• Formula: C46 H32 Cl10 O4 P2 Pd
• Calculated formula: C46 H32 Cl10 O4 P2 Pd
• SMILES: [Pd]1234([P](c5ccc(Cl)cc5)(c5ccc(Cl)cc5)c5ccc(Cl)cc5)([P](c5ccc(Cl)cc5)(c5ccc(Cl)cc5)c5ccc(Cl)cc5)[c]56[c]2(cccc5)[cH]3[cH]4[cH]16.Cl(=O)(=O)(=O)[O-].C(Cl)(Cl)Cl
• Title of publication: Cationic Palladium(II)-Indenyl complexes bearing phosphines as ancillary ligands: synthesis, study of indenyl amination and anticancer activity
• Authors of publication: Scattolin, Thomas; Visentin, Fabiano; Bortolamiol, Enrica; Caligiuri, Isabella; Rizzolio, Flavio; Cavallo, Luigi; Zhang, Ziyun; Demitri, Nicola; Fama, Francesco
• Journal of publication: Dalton Transactions
• Year of publication: 2022
• a: 11.467 ± 0.002 Å
• b: 34.352 ± 0.007 Å
• c: 12.671 ± 0.003 Å
• α: 90°
• β: 106.03 ± 0.03°
• γ: 90°
• Cell volume: 4797.2 ± 1.9 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 6
• 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: 0.044
• Residual factor for significantly intense reflections: 0.0387
• Weighted residual factors for significantly intense reflections: 0.1023
• Weighted residual factors for all reflections included in the refinement: 0.1065
• Goodness-of-fit parameter for all reflections included in the refinement: 1.025
• Diffraction radiation wavelength: 0.62 Å
• Diffraction radiation type: Synchrotron
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No