Information card for entry 4122895

Structure parameters

• Formula: C41 H39 N4 O5 Pt S2
• Calculated formula: C41 H39 N4 O5 Pt S2
• 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: 11.298 ± 0.002 Å
• b: 13.599 ± 0.003 Å
• c: 13.964 ± 0.003 Å
• α: 75.51 ± 0.03°
• β: 86.77 ± 0.03°
• γ: 69.05 ± 0.03°
• Cell volume: 1938.6 ± 0.8 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 6
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0475
• Residual factor for significantly intense reflections: 0.0352
• Weighted residual factors for significantly intense reflections: 0.0813
• Weighted residual factors for all reflections included in the refinement: 0.1032
• Goodness-of-fit parameter for all reflections included in the refinement: 1.099
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No