Information card for entry 4068610

Structure parameters

• Formula: C42 H38 Br6 N4 Pt
• Calculated formula: C42 H38 Br6 N4 Pt
• SMILES: c1n(c2ccccc2[n+]1Cc1ccccc1)Cc1ccccc1.Br[Pt](Br)(Br)(Br)([Br-])[Br-].c1n(c2ccccc2[n+]1Cc1ccccc1)Cc1ccccc1
• Title of publication: Novel Pt(II) Mono- and Biscarbene Complexes: Synthesis, Structural Characterization and Application in Hydrosilylation Catalysis
• Authors of publication: Hu, Jian Jin; Li, Fuwei; Hor, T. S. Andy
• Journal of publication: Organometallics
• Year of publication: 2009
• Journal volume: 28
• Journal issue: 4
• Pages of publication: 1212
• a: 8.5907 ± 0.0009 Å
• b: 11.9725 ± 0.0013 Å
• c: 12.6266 ± 0.0013 Å
• α: 63.442 ± 0.002°
• β: 84.174 ± 0.002°
• γ: 71.003 ± 0.002°
• Cell volume: 1096.9 ± 0.2 ų
• Cell temperature: 295 ± 2 K
• Ambient diffraction temperature: 295 ± 2 K
• Number of distinct elements: 5
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0843
• Residual factor for significantly intense reflections: 0.0598
• Weighted residual factors for significantly intense reflections: 0.1104
• Weighted residual factors for all reflections included in the refinement: 0.1196
• Goodness-of-fit parameter for all reflections included in the refinement: 0.982
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No