Information card for entry 4122897

Structure parameters

• Formula: C75 H76 N8 O9 Pt2 S4
• Calculated formula: C75 H76 N8 O9 Pt2 S4
• Title of publication: Synthesis, Spectroscopic Properties, and Photoconductivity of Black Absorbers Consisting of Pt(Bipyridine)(Dithiolate) Charge Transfer Complexes in the Presence and Absence of Nitrofluorenone Acceptors.
• Authors of publication: Browning, Charles; Hudson, Joshua M.; Reinheimer, Eric W.; Kuo, Fang-Ling; McDougald, Jr, Roy N; Rabaâ, Hassan; Pan, Hongjun; Bacsa, John; Wang, Xiaoping; Dunbar, Kim R.; Shepherd, Nigel D.; Omary, Mohammad A.
• Journal of publication: Journal of the American Chemical Society
• Year of publication: 2014
• Pages of publication: 141107065104007
• a: 11.257 ± 0.002 Å
• b: 26.004 ± 0.005 Å
• c: 24.165 ± 0.005 Å
• α: 90°
• β: 92.19 ± 0.03°
• γ: 90°
• Cell volume: 7069 ± 2 ų
• Cell temperature: 100 K
• Ambient diffraction temperature: 100 K
• Number of distinct elements: 6
• 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: 0.2769
• Residual factor for significantly intense reflections: 0.0931
• Weighted residual factors for significantly intense reflections: 0.1707
• Weighted residual factors for all reflections included in the refinement: 0.2442
• Goodness-of-fit parameter for all reflections included in the refinement: 0.919
• Diffraction radiation wavelength: 1.54184 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No