Information card for entry 4071574

Structure parameters

• Formula: C16 H21 I N2 Pt
• Calculated formula: C16 H21 I N2 Pt
• SMILES: [Pt]1(I)([NH2][C@@H](c2c1cccc2)C)[NH2][C@@H](c1ccccc1)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: 4.6146 ± 0.0003 Å
• b: 11.7364 ± 0.0008 Å
• c: 29.866 ± 0.002 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 1617.51 ± 0.19 ų
• Cell temperature: 173 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 5
• 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: 0.0331
• Residual factor for significantly intense reflections: 0.0301
• Weighted residual factors for significantly intense reflections: 0.0609
• Weighted residual factors for all reflections included in the refinement: 0.0616
• Goodness-of-fit parameter for all reflections included in the refinement: 1.07
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No