Information card for entry 7054680

Structure parameters

• Formula: C17 H27 I N2 Pt
• Calculated formula: C17 H27 I N2 Pt
• SMILES: [Pt](I)([n]1ccc(cc1)CC)([n]1ccc(cc1)CC)(C)(C)C
• Title of publication: Substituent effects in solution speciation of the mononuclear and dinuclear trimethylplatinum(iv) iodide complexes of pyridines
• Authors of publication: Ghosh, Biswa Nath; Lentz, Dieter; Schlecht, Sabine
• Journal of publication: New J. Chem.
• Year of publication: 2015
• Journal volume: 39
• Journal issue: 5
• Pages of publication: 3536
• a: 12.0156 ± 0.0017 Å
• b: 12.0304 ± 0.0017 Å
• c: 13.4566 ± 0.0019 Å
• α: 90°
• β: 102.37 ± 0.003°
• γ: 90°
• Cell volume: 1900 ± 0.5 ų
• Cell temperature: 133 ± 2 K
• Ambient diffraction temperature: 133 ± 2 K
• Number of distinct elements: 5
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/c 1
• Hall space group symbol: -P 2ybc
• Residual factor for all reflections: 0.0184
• Residual factor for significantly intense reflections: 0.0146
• Weighted residual factors for significantly intense reflections: 0.0344
• Weighted residual factors for all reflections included in the refinement: 0.0359
• Goodness-of-fit parameter for all reflections included in the refinement: 1.079
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No