Information card for entry 4303364

Structure parameters

• Common name: B1
• Formula: C80 H60 Cl10 O5 P4 Pt2
• Calculated formula: C80 H60 Cl10 O5 P4 Pt2
• SMILES: c12cccc3c2C2(O[Pt]([P]1(c1ccccc1)c1ccccc1)([P](c1c2c(ccc1)C3=O)(c1ccccc1)c1ccccc1)Cl)OC12O[Pt]3([P](c4cccc(C(=O)c5cccc([P]3(c3ccccc3)c3ccccc3)c15)c24)(c1ccccc1)c1ccccc1)Cl.C(Cl)Cl.C(Cl)Cl.C(Cl)Cl.C(Cl)Cl
• Title of publication: Photooxidation of a Platinum-Anthracene Pincer Complex: Formation and Structures of PtII-Anthrone and -Ketal Complexes
• Authors of publication: Jian Hu; Huan Xu; Minh-Hai Nguyen; John H. K. Yip
• Journal of publication: Inorganic Chemistry
• Year of publication: 2009
• Journal volume: 48
• Pages of publication: 9684 - 9692
• a: 29.565 ± 0.002 Å
• b: 12.9527 ± 0.0007 Å
• c: 23.9535 ± 0.0015 Å
• α: 90°
• β: 125.014 ± 0.001°
• γ: 90°
• Cell volume: 7512.7 ± 0.8 ų
• Cell temperature: 223 ± 2 K
• Ambient diffraction temperature: 223 ± 2 K
• Number of distinct elements: 6
• Space group number: 15
• Hermann-Mauguin space group symbol: C 1 2/c 1
• Hall space group symbol: -C 2yc
• Residual factor for all reflections: 0.077
• Residual factor for significantly intense reflections: 0.0561
• Weighted residual factors for significantly intense reflections: 0.1555
• Weighted residual factors for all reflections included in the refinement: 0.1673
• Goodness-of-fit parameter for all reflections included in the refinement: 1.067
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No