Information card for entry 4080166

Structure parameters

• Common name: 8
• Formula: C61.5 H103 F6 O7.5 P6 Pt2 S2
• Calculated formula: C61.5 H103 F6 O7.5 P6 Pt2 S2
• Title of publication: Ligand Perturbations on Fluorescence of Dinuclear Platinum Complexes of 5,12-Diethynyltetracene: A Spectroscopic and Computational Study
• Authors of publication: Nguyen, Minh-Hai; Wong, Chun-Yuen; Yip, John H. K.
• Journal of publication: Organometallics
• Year of publication: 2013
• Journal volume: 32
• Journal issue: 6
• Pages of publication: 1620
• a: 22.9582 ± 0.001 Å
• b: 10.8973 ± 0.0005 Å
• c: 29.5076 ± 0.0013 Å
• α: 90°
• β: 91.5 ± 0.001°
• γ: 90°
• Cell volume: 7379.8 ± 0.6 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 7
• 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: 0.0802
• Residual factor for significantly intense reflections: 0.0572
• Weighted residual factors for significantly intense reflections: 0.1438
• Weighted residual factors for all reflections included in the refinement: 0.1581
• Goodness-of-fit parameter for all reflections included in the refinement: 1.053
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No