Information card for entry 4324591

Structure parameters

• Common name: cis-[Pt(CH2C6H4Cl)2(PEt3)2]
• Formula: C26 H42 Cl2 P2 Pt
• Calculated formula: C26 H42 Cl2 P2 Pt
• SMILES: [Pt](Cc1ccc(cc1)Cl)(Cc1ccc(cc1)Cl)([P](CC)(CC)CC)[P](CC)(CC)CC
• Title of publication: Mechanistic Insight into Protonolysis and Cis-Trans Isomerization of Benzylplatinum(II) Complexes Assisted by Weak Ligand-to-Metal Interactions. A Combined Kinetic and DFT Study
• Authors of publication: Emanuela Guido; Giuseppina D'Amico; Nino Russo; Emilia Sicilia; Silvia Rizzato; Alberto Albinati; Andrea Romeo; M. Rosaria Plutino; Raffaello Romeo
• Journal of publication: Inorganic Chemistry
• Year of publication: 2011
• Journal volume: 50
• Pages of publication: 2224 - 2239
• a: 12.5916 ± 0.0013 Å
• b: 31.223 ± 0.003 Å
• c: 8.4416 ± 0.0009 Å
• α: 90°
• β: 120.802 ± 0.002°
• γ: 90°
• Cell volume: 2850.7 ± 0.5 ų
• Cell temperature: 295 ± 2 K
• Ambient diffraction temperature: 295 ± 2 K
• Number of distinct elements: 5
• Space group number: 9
• Hermann-Mauguin space group symbol: C 1 c 1
• Hall space group symbol: C -2yc
• Residual factor for all reflections: 0.0352
• Residual factor for significantly intense reflections: 0.027
• Weighted residual factors for significantly intense reflections: 0.0601
• Weighted residual factors for all reflections included in the refinement: 0.0645
• Goodness-of-fit parameter for all reflections included in the refinement: 1.047
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No