Information card for entry 4071576

Structure parameters

• Formula: C16 H19 F2 I N2 Pt
• Calculated formula: C16 H19 F2 I N2 Pt
• SMILES: [Pt]1(I)([NH2][C@@H](c2c1cc(F)cc2)C)[NH2][C@@H](c1ccc(F)cc1)C
• Title of publication: Orthoplatination of Primary Amines
• Authors of publication: Calmuschi-Cula, Beatrice; Englert, Ulli
• Journal of publication: Organometallics
• Year of publication: 2008
• Journal volume: 27
• Journal issue: 13
• Pages of publication: 3124
• a: 4.5846 ± 0.0013 Å
• b: 11.894 ± 0.003 Å
• c: 30.144 ± 0.009 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 1643.7 ± 0.8 ų
• Cell temperature: 130 ± 2 K
• Ambient diffraction temperature: 130 ± 2 K
• Number of distinct elements: 6
• Space group number: 19
• Hermann-Mauguin space group symbol: P 21 21 21
• Hall space group symbol: P 2ac 2ab
• Residual factor for all reflections: 0.0572
• Residual factor for significantly intense reflections: 0.0453
• Weighted residual factors for significantly intense reflections: 0.075
• Weighted residual factors for all reflections included in the refinement: 0.0766
• Goodness-of-fit parameter for all reflections included in the refinement: 1.001
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No