Information card for entry 4074817

Structure parameters

• Formula: C20 H35 B F4 N P Pt S
• Calculated formula: C20 H35 B F4 N P Pt S
• SMILES: [Pt]1([S](C)C)([P](C2=C([N]1(C)C)Cc1c2cccc1)(C(C)C)C(C)C)C.[B](F)(F)(F)[F-]
• Title of publication: Neutral and Cationic Platinum(II) Complexes Supported by a P,N-Functionalized Indene Ligand: Structural and Reactivity Comparisons with a Related Gold(III) Zwitterion
• Authors of publication: Wile, Bradley M.; Burford, Richard J.; McDonald, Robert; Ferguson, Michael J.; Stradiotto, Mark
• Journal of publication: Organometallics
• Year of publication: 2006
• Journal volume: 25
• Journal issue: 4
• Pages of publication: 1028
• a: 9.4505 ± 0.0006 Å
• b: 18.1064 ± 0.0011 Å
• c: 14.4908 ± 0.0009 Å
• α: 90°
• β: 92.359 ± 0.001°
• γ: 90°
• Cell volume: 2477.5 ± 0.3 ų
• Cell temperature: 193 ± 2 K
• Ambient diffraction temperature: 193 ± 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: 0.0249
• Residual factor for significantly intense reflections: 0.0211
• Weighted residual factors for significantly intense reflections: 0.0524
• Weighted residual factors for all reflections included in the refinement: 0.0542
• Goodness-of-fit parameter for all reflections included in the refinement: 1.068
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No