Information card for entry 7060115

Structure parameters

• Formula: C52 H79 Cl6 N O3 P2 Pt Se Sn5
• Calculated formula: C52 H79 Cl6 N O3 P2 Pt Se Sn5
• Title of publication: A serendipitous isolation of cocrystallized platinum‒tin complexes: synthesis, structure and theoretical exploration
• Authors of publication: Chauhan, Rohit Singh; Singh, Saurabh Kumar; Tyagi, Adish; Golen, James A.; Rheingold, Arnold L.
• Journal of publication: New Journal of Chemistry
• Year of publication: 2020
• Journal volume: 44
• Journal issue: 48
• Pages of publication: 20945 - 20955
• a: 12.2292 ± 0.0006 Å
• b: 16.2125 ± 0.0009 Å
• c: 17.2666 ± 0.0009 Å
• α: 92.263 ± 0.002°
• β: 107.239 ± 0.002°
• γ: 97.212 ± 0.002°
• Cell volume: 3233.1 ± 0.3 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 9
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0888
• Residual factor for significantly intense reflections: 0.0546
• Weighted residual factors for significantly intense reflections: 0.1102
• Weighted residual factors for all reflections included in the refinement: 0.1208
• Goodness-of-fit parameter for all reflections included in the refinement: 1.089
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No