Information card for entry 7126573

Structure parameters

• Formula: C72 H74 F10 O4 P2 Pt
• Calculated formula: C72 H74 F10 O4 P2 Pt
• Title of publication: Turning on solid-state phosphorescence of platinum acetylides with aromatic stacking.
• Authors of publication: Mullin, William J.; Qin, Huan; Mani, Tomoyasu; Müller, Peter; Panzer, Matthew J.; Thomas, Samuel W.
• Journal of publication: Chemical communications (Cambridge, England)
• Year of publication: 2020
• Journal volume: 56
• Journal issue: 50
• Pages of publication: 6854 - 6857
• a: 17.9125 ± 0.0008 Å
• b: 21.095 ± 0.001 Å
• c: 21.0976 ± 0.0008 Å
• α: 60.1816 ± 0.0013°
• β: 89.8948 ± 0.0015°
• γ: 76.3364 ± 0.0017°
• Cell volume: 6657.3 ± 0.5 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: 0.0782
• Residual factor for significantly intense reflections: 0.0547
• Weighted residual factors for significantly intense reflections: 0.1112
• Weighted residual factors for all reflections included in the refinement: 0.1314
• Goodness-of-fit parameter for all reflections included in the refinement: 1.091
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No