Information card for entry 7114306

Structure parameters

• Formula: C36 H69 B2 Cl2 F9 N2 P4 Pt2
• Calculated formula: C36 H69 B2 Cl2 F9 N2 P4 Pt2
• SMILES: [Pt](Cl)([P](CC)(CC)CC)([P](CC)(CC)CC)[NH]=C1C=CC(C=C1)=C1C=C(F)C=CC1=[NH][Pt](Cl)([P](CC)(CC)CC)[P](CC)(CC)CC.[B](F)(F)(F)[F-].[B](F)(F)(F)[F-]
• Title of publication: Oxidative coupling of platinum arylamides: temperature dependent C‒H or C‒F cleavage
• Authors of publication: Albéniz, Ana C.; Calle, Virginia; Espinet, Pablo; Gómez, Sandra
• Journal of publication: Chemical Communications
• Year of publication: 2002
• Journal issue: 6
• Pages of publication: 610
• a: 16.155 ± 0.005 Å
• b: 14.825 ± 0.004 Å
• c: 22.22 ± 0.006 Å
• α: 90°
• β: 100.537 ± 0.007°
• γ: 90°
• Cell volume: 5232 ± 3 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 8
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/n 1
• Hall space group symbol: -P 2yn
• Residual factor for all reflections: 0.1144
• Residual factor for significantly intense reflections: 0.0471
• Weighted residual factors for significantly intense reflections: 0.101
• Weighted residual factors for all reflections included in the refinement: 0.1203
• Goodness-of-fit parameter for all reflections included in the refinement: 1.002
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No