Information card for entry 4348624

Structure parameters

• Formula: C28 H24 F12 N8 P2 Pt
• Calculated formula: C28 H24 F12 N8 P2 Pt
• SMILES: c1cccc2c3cn(Cc4ccccc4)n[n]3[Pt]3([n]12)[n]1ccccc1c1cn(Cc2ccccc2)n[n]31.[P](F)(F)(F)(F)(F)[F-].[P](F)(F)(F)(F)(F)[F-]
• Title of publication: Heterometallic [MnPtn(L)2n](x+) Macrocycles from Dichloromethane-Derived Bis-2-pyridyl-1,2,3-triazole Ligands.
• Authors of publication: Preston, Dan; Tucker, Robert A. J.; Garden, Anna L.; Crowley, James D.
• Journal of publication: Inorganic chemistry
• Year of publication: 2016
• Journal volume: 55
• Journal issue: 17
• Pages of publication: 8928 - 8934
• a: 6.2646 ± 0.0002 Å
• b: 14.6852 ± 0.0003 Å
• c: 17.0756 ± 0.0004 Å
• α: 90°
• β: 95.581 ± 0.002°
• γ: 90°
• Cell volume: 1563.46 ± 0.07 ų
• Cell temperature: 100.01 ± 0.1 K
• Ambient diffraction temperature: 100.01 ± 0.1 K
• Number of distinct elements: 6
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/c 1
• Hall space group symbol: -P 2ybc
• Residual factor for all reflections: 0.0789
• Residual factor for significantly intense reflections: 0.071
• Weighted residual factors for significantly intense reflections: 0.1791
• Weighted residual factors for all reflections included in the refinement: 0.1895
• Goodness-of-fit parameter for all reflections included in the refinement: 1.348
• Diffraction radiation wavelength: 1.54184 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No