Information card for entry 1555896

Structure parameters

• Formula: C145 H144 N4 O5 Pt2 S32
• Calculated formula: C145 H144 N4 O5 Pt2 S32
• Title of publication: C₆₀ Recognition from Extended Tetrathiafulvalene Bis-acetylide Platinum(II) Complexes.
• Authors of publication: Bastien, Guillaume; Dron, Paul I.; Vincent, Manon; Canevet, David; Allain, Magali; Goeb, Sébastien; Sallé, Marc
• Journal of publication: Organic letters
• Year of publication: 2016
• Journal volume: 18
• Journal issue: 22
• Pages of publication: 5856 - 5859
• a: 15.954 ± 0.003 Å
• b: 16.992 ± 0.002 Å
• c: 17.29 ± 0.004 Å
• α: 107.17 ± 0.01°
• β: 114.97 ± 0.01°
• γ: 94.23 ± 0.01°
• Cell volume: 3951.8 ± 1.4 ų
• Cell temperature: 200 ± 2 K
• Ambient diffraction temperature: 200 ± 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: 0.1569
• Residual factor for significantly intense reflections: 0.067
• Weighted residual factors for significantly intense reflections: 0.128
• Weighted residual factors for all reflections included in the refinement: 0.176
• Goodness-of-fit parameter for all reflections included in the refinement: 1.123
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No