Information card for entry 4317627

Structure parameters

• Formula: C82.5 H84 Cl5 F12 O3.5 P6 Pt3 Se2
• Calculated formula: C82.5 H72 Cl5 F12 O3.5 P6 Pt3 Se2
• Title of publication: Metal Scrambling in the Trinuclear {Pt2Se2M} (M = Pt, Pd, Au) System Using an Electrospray Mass Spectrometry (ESMS) Directed Synthetic Methodology; Isolation and Crystallographic Characterization of {Pt2(μ3-Se)2(PPh3)4[Pt(cod)]}{PF6}2 and {Pt(μ3-Se)2(PPh3)2[Pt(cod)]2}{PF6}2 (cod = Cyclo-octa-1,5-diene)
• Authors of publication: Jeremy S. L. Yeo; Jagadese J. Vittal; William Henderson; T. S. Andy Hor
• Journal of publication: Inorganic Chemistry
• Year of publication: 2002
• Journal volume: 41
• Pages of publication: 1194 - 1198
• a: 17.693 ± 0.003 Å
• b: 23.952 ± 0.004 Å
• c: 21.129 ± 0.004 Å
• α: 90°
• β: 91.272 ± 0.005°
• γ: 90°
• Cell volume: 8952 ± 3 ų
• Cell temperature: 223 ± 2 K
• Ambient diffraction temperature: 223 ± 2 K
• Number of distinct elements: 8
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/n 1
• Hall space group symbol: -P 2yn
• Residual factor for all reflections: 0.0765
• Residual factor for significantly intense reflections: 0.0482
• Weighted residual factors for significantly intense reflections: 0.1163
• Weighted residual factors for all reflections included in the refinement: 0.1247
• Goodness-of-fit parameter for all reflections included in the refinement: 0.981
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No