Information card for entry 7111825

Structure parameters

• Formula: C86 H84 B F24 I2 N4 Pt
• Calculated formula: C86 H84 B F24 I2 N4 Pt
• Title of publication: A stable, mononuclear, cationic Pt(III) complex stabilised by bulky N-heterocyclic carbenes
• Authors of publication: Orestes Rivada-Wheelaghan; Manuel A. Ortuno; Sergio E. Garcia-Garrido; Josefina Diez; Pablo J. Alonso; Agusti Lledos; Salvador Conejero
• Journal of publication: Chem.Commun.
• Year of publication: 2014
• Journal volume: 50
• Pages of publication: 1299
• a: 19.6292 ± 0.0002 Å
• b: 21.8184 ± 0.0002 Å
• c: 20.7055 ± 0.0002 Å
• α: 90°
• β: 94.328 ± 0.001°
• γ: 90°
• Cell volume: 8842.42 ± 0.15 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 7
• Space group number: 13
• Hermann-Mauguin space group symbol: P 1 2/n 1
• Hall space group symbol: -P 2yac
• Residual factor for all reflections: 0.0542
• Residual factor for significantly intense reflections: 0.0452
• Weighted residual factors for significantly intense reflections: 0.1212
• Weighted residual factors for all reflections included in the refinement: 0.1311
• Goodness-of-fit parameter for all reflections included in the refinement: 1.029
• Diffraction radiation wavelength: 1.5418 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No