Information card for entry 4068349

Structure parameters

• Formula: C23 H23 I2 N2 P Pt
• Calculated formula: C23 H23 I2 N2 P Pt
• SMILES: [Pt](I)(I)([P](c1ccccc1)(c1ccccc1)c1ccccc1)=C1N(C=CN1C)C
• Title of publication: Platinum(II) Complexes Featuring Chiral Diphosphines and N-Heterocyclic Carbene Ligands: Synthesis and Evaluation as Cycloisomerization Catalysts
• Authors of publication: Brissy, Delphine; Skander, Myriem; Retailleau, Pascal; Frison, Gilles; Marinetti, Angela
• Journal of publication: Organometallics
• Year of publication: 2009
• Journal volume: 28
• Journal issue: 1
• Pages of publication: 140
• a: 16.828 ± 0.003 Å
• b: 15.926 ± 0.002 Å
• c: 18.622 ± 0.002 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 4990.7 ± 1.2 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 6
• Space group number: 61
• Hermann-Mauguin space group symbol: P b c a
• Hall space group symbol: -P 2ac 2ab
• Residual factor for all reflections: 0.0704
• Residual factor for significantly intense reflections: 0.0409
• Weighted residual factors for significantly intense reflections: 0.0954
• Weighted residual factors for all reflections included in the refinement: 0.1111
• Goodness-of-fit parameter for all reflections included in the refinement: 1.021
• Diffraction radiation wavelength: 0.7107 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No