Information card for entry 7050577

Structure parameters

• Formula: C115 H82 B2 Cl2 F48 N6 Pt2
• Calculated formula: C115 H78 B2 Cl2 F48 N6 Pt2
• Title of publication: [2.1.1]-(2,6)-Pyridinophane(L)-controlled alkane C‒H bond cleavage: (L)PtMe2H+ as a precursor to the geometrically “tense” transient (L)PtMe+Electronic supplementary information (ESI) available: complete experimental and characterization data. See http://www.rsc.org/suppdata/nj/b3/b302055j/.
• Authors of publication: Vedernikov, Andrei N.; Huffman, John C.; Caulton, Kenneth G.
• Journal of publication: New Journal of Chemistry
• Year of publication: 2003
• Journal volume: 27
• Journal issue: 4
• Pages of publication: 665
• a: 39.241 ± 0.0014 Å
• b: 12.4804 ± 0.0005 Å
• c: 24.5612 ± 0.0009 Å
• α: 90°
• β: 113.129 ± 0.003°
• γ: 90°
• Cell volume: 11061.9 ± 0.8 ų
• Cell temperature: 115 ± 2 K
• Ambient diffraction temperature: 115 ± 2 K
• Number of distinct elements: 7
• Space group number: 15
• Hermann-Mauguin space group symbol: C 1 2/c 1
• Hall space group symbol: -C 2yc
• Residual factor for significantly intense reflections: 0.0336
• Weighted residual factors for all reflections included in the refinement: 0.0432
• Goodness-of-fit parameter for all reflections included in the refinement: 1.541
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No