Information card for entry 4348916

Structure parameters

• Formula: C82 H72 B2 N2 O4 Pt2 S2
• Calculated formula: C82 H72 B2 N2 O4 Pt2 S1.4
• Title of publication: Tuning the Phosphorescence and Solid State Luminescence of Triarylborane-Functionalized Acetylacetonato Platinum Complexes.
• Authors of publication: Rajendra Kumar, George; Thilagar, Pakkirisamy
• Journal of publication: Inorganic chemistry
• Year of publication: 2016
• Journal volume: 55
• Journal issue: 23
• Pages of publication: 12220 - 12229
• a: 18.031 ± 0.005 Å
• b: 11.522 ± 0.003 Å
• c: 16.951 ± 0.005 Å
• α: 90°
• β: 94.604 ± 0.017°
• γ: 90°
• Cell volume: 3510.3 ± 1.7 ų
• Cell temperature: 273 K
• Ambient diffraction temperature: 273 ± 2 K
• Number of distinct elements: 7
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/c 1
• Hall space group symbol: -P 2ybc
• Residual factor for all reflections: 0.1284
• Residual factor for significantly intense reflections: 0.0762
• Weighted residual factors for significantly intense reflections: 0.1975
• Weighted residual factors for all reflections included in the refinement: 0.2679
• Goodness-of-fit parameter for all reflections included in the refinement: 1.2216
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No