Information card for entry 7109114

Structure parameters

• Formula: C30 H33 F3 N P Pt
• Calculated formula: C30 H33 F3 N P Pt
• SMILES: [Pt]12([P](C(C)(C)C2)(c2c3c(ccc2C)cccc13)C(C)(C)C)(F)([n]1ccccc1)c1cc(F)cc(F)c1
• Title of publication: Unprecedented 1,3-migration of the aryl ligand in metallacyclic aryl alpha-naphthyl Pt(IV) difluorides to produce beta-arylnaphthyl Pt(II) complexes
• Authors of publication: Ina S. Dubinsky-Davidchik; Israel Goldberg; Arkadi Vigalok; Andrei N. Vedernikov
• Journal of publication: Chem.Commun.
• Year of publication: 2013
• Journal volume: 49
• Pages of publication: 3446
• a: 34.5182 ± 0.0011 Å
• b: 7.8685 ± 0.0006 Å
• c: 26.5569 ± 0.0009 Å
• α: 90°
• β: 116.11 ± 0.04°
• γ: 90°
• Cell volume: 6477 ± 2 ų
• Cell temperature: 110 ± 2 K
• Ambient diffraction temperature: 110 ± 2 K
• Number of distinct elements: 6
• Space group number: 15
• Hermann-Mauguin space group symbol: C 1 2/c 1
• Hall space group symbol: -C 2yc
• Residual factor for all reflections: 0.0594
• Residual factor for significantly intense reflections: 0.0417
• Weighted residual factors for significantly intense reflections: 0.0972
• Weighted residual factors for all reflections included in the refinement: 0.1033
• Goodness-of-fit parameter for all reflections included in the refinement: 0.976
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No