Information card for entry 4312005

Structure parameters

• Common name: Chugaev's PF6 salt dichloromethane solvate
• Formula: C8.98 H16.95 Cl1.95 F6 N6 P Pt
• Calculated formula: C8.975 H16.95 Cl1.95 F6 N6 P Pt
• Title of publication: Effects of Pt...Pt Bonding, Anions, Solvate Molecules, and Hydrogen Bonding on the Self-Association of Chugaev's Cation, a Platinum Complex with a Chelating Carbene Ligand
• Authors of publication: Jay R. Stork; Marilyn M. Olmstead; Alan L. Balch
• Journal of publication: Inorganic Chemistry
• Year of publication: 2004
• Journal volume: 43
• Pages of publication: 7508 - 7515
• a: 10.681 ± 0.003 Å
• b: 19.021 ± 0.006 Å
• c: 20.62 ± 0.007 Å
• α: 90°
• β: 90.446 ± 0.007°
• γ: 90°
• Cell volume: 4189 ± 2 ų
• Cell temperature: 90 ± 2 K
• Ambient diffraction temperature: 90 ± 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: 0.0884
• Residual factor for significantly intense reflections: 0.082
• Weighted residual factors for significantly intense reflections: 0.1882
• Weighted residual factors for all reflections included in the refinement: 0.1919
• Goodness-of-fit parameter for all reflections included in the refinement: 1.219
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No