Information card for entry 7011701

Structure parameters

• Formula: C48 H34 F12 O2 P2 Pt2
• Calculated formula: C48 H34 F12 O2 P2 Pt2
• Title of publication: Reaction of triangulo-clusters [Pt3(μ-CO)3(PR3)3] with hexafluorobutyne. The X-ray crystal structures of [Pt2(CO)2(PR3)2(μ-η2:η2-CF3CCCF3)](PR3= PPh3 or PCy3) and [Pt2(CO)2(PBzPh2)(μ-η1:η1-CF3CCCF3)2]
• Authors of publication: Renzo Ros; Augusto Tassan; Raymond Roulet; Gàbor Laurenczy; Virginie Duprez; Kurt Schenk
• Journal of publication: J. Chem. Soc., Dalton Trans.
• Year of publication: 2002
• Journal issue: 18
• Pages of publication: 3565 - 3570
• a: 13.001 ± 0.003 Å
• b: 13.74 ± 0.003 Å
• c: 26.58 ± 0.005 Å
• α: 90°
• β: 104.03 ± 0.03°
• γ: 90°
• Cell volume: 4606.4 ± 1.8 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 6
• 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: 0.0416
• Residual factor for significantly intense reflections: 0.027
• Weighted residual factors for all reflections: 0.0411
• Weighted residual factors for significantly intense reflections: 0.0402
• Goodness-of-fit parameter for all reflections: 2.42
• Goodness-of-fit parameter for significantly intense reflections: 2.687
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No