Information card for entry 4075675

Structure parameters

• Formula: C58 H88 I2 P4 Pt2
• Calculated formula: C58 I2 P4 Pt2
• SMILES: [Pt](I)([P](CC)(CC)CC)([P](CC)(CC)CC)C#Cc1cc(ccc1C#Cc1ccccc1C#Cc1ccc(cc1C#C[Pt](I)([P](CC)(CC)CC)[P](CC)(CC)CC)C(C)(C)C)C(C)(C)C
• Title of publication: Selective Metallacyclization and Crystallographic Characterization of Structurally Related Platina-annulenes
• Authors of publication: Johnson, Charles A.; Haley, Michael M.; Rather, Elisabeth; Han, Fusen; Weakley, Timothy J. R.
• Journal of publication: Organometallics
• Year of publication: 2005
• Journal volume: 24
• Journal issue: 6
• Pages of publication: 1161
• a: 43.088 ± 0.006 Å
• b: 9.179 ± 0.003 Å
• c: 33.478 ± 0.004 Å
• α: 90°
• β: 94.949 ± 0.011°
• γ: 90°
• Cell volume: 13191 ± 5 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 5
• 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: 0.1571
• Residual factor for significantly intense reflections: 0.0686
• Weighted residual factors for significantly intense reflections: 0.1896
• Weighted residual factors for all reflections included in the refinement: 0.2199
• Goodness-of-fit parameter for all reflections included in the refinement: 0.96
• Diffraction radiation wavelength: 0.7107 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No