Information card for entry 7000691

Structure parameters

• Formula: C65 H55 Cl3 O3 P4 Pt2 S4
• Calculated formula: C65 H49 Cl3 O3 P4 Pt2 S4
• Title of publication: Heteroleptic binuclear palladium(II) and platinum(II) complexes containing 1,2-bis(diphenylphosphino)acetylene and 1,2-benzenedithiolates: syntheses, crystal structures, electrochemistry and photoluminescence properties
• Authors of publication: Shin, Kyong-Soon; Son, Kyung-In; Kim, Jae Il; Hong, Chang Seop; Suh, Myungkoo; Noh, Dong-Youn
• Journal of publication: Dalton Transactions
• Year of publication: 2009
• Journal issue: 10
• Pages of publication: 1767 - 1775
• a: 10.6227 ± 0.0012 Å
• b: 14.2985 ± 0.0012 Å
• c: 23.709 ± 0.003 Å
• α: 74.885 ± 0.001°
• β: 86.509 ± 0.001°
• γ: 71.508 ± 0.001°
• Cell volume: 3296.1 ± 0.6 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 7
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0492
• Residual factor for significantly intense reflections: 0.0393
• Weighted residual factors for significantly intense reflections: 0.1289
• Weighted residual factors for all reflections included in the refinement: 0.1382
• Goodness-of-fit parameter for all reflections included in the refinement: 1.059
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No