Information card for entry 7054685

Structure parameters

• Formula: C18 H32 I2 N2 O2 Pt2
• Calculated formula: C18 H32 I2 N2 O2 Pt2
• SMILES: [Pt]1([I][Pt]([I]1)([n]1ccc(OC)cc1)(C)(C)C)([n]1ccc(OC)cc1)(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: 10.407 ± 0.0009 Å
• b: 11.7649 ± 0.0006 Å
• c: 20.7823 ± 0.0017 Å
• α: 90°
• β: 98.377 ± 0.01°
• γ: 90°
• Cell volume: 2517.4 ± 0.3 ų
• Cell temperature: 193 ± 2 K
• Ambient diffraction temperature: 193 ± 2 K
• Number of distinct elements: 6
• 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: 0.0334
• Residual factor for significantly intense reflections: 0.0232
• Weighted residual factors for significantly intense reflections: 0.0493
• Weighted residual factors for all reflections included in the refinement: 0.0512
• Goodness-of-fit parameter for all reflections included in the refinement: 0.928
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No