Information card for entry 7056150

Structure parameters

• Formula: C15 H17 I N4 Pt
• Calculated formula: C15 H17 I N4 Pt
• SMILES: [Pt](I)([n]1cc(ccc1)C#N)([n]1cc(ccc1)C#N)(C)(C)C
• Title of publication: Mononuclear and dinuclear trimethylplatinum(iv) iodide complexes of 3-substituted pyridines
• Authors of publication: Ghosh, Biswa Nath; Schlecht, Sabine; Bauzá, Antonio; Frontera, Antonio
• Journal of publication: New J. Chem.
• Year of publication: 2017
• Journal volume: 41
• Journal issue: 9
• Pages of publication: 3498
• a: 13.06443 ± 0.00014 Å
• b: 10.05977 ± 0.00012 Å
• c: 13.11539 ± 0.00014 Å
• α: 90°
• β: 92.2805 ± 0.001°
• γ: 90°
• Cell volume: 1722.33 ± 0.03 ų
• Cell temperature: 173 ± 2 K
• Ambient diffraction temperature: 173 ± 2 K
• Number of distinct elements: 5
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/n 1
• Hall space group symbol: -P 2yn
• Residual factor for all reflections: 0.0244
• Residual factor for significantly intense reflections: 0.0227
• Weighted residual factors for significantly intense reflections: 0.0571
• Weighted residual factors for all reflections included in the refinement: 0.0581
• 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