Information card for entry 4078278

Structure parameters

• Formula: C28 H42 B K N8 O8 Pt
• Calculated formula: C28 H42 B K N8 O8 Pt
• SMILES: C1([Pt]2(C(=[O][K]34567([O]=1)[O]1CC[O]3CC[O]4CC[O]5CC[O]7CC[O]6CC1)C)[n]1cccn1[B](n1ccc[n]21)(n1cccn1)n1cccn1)C
• Title of publication: Synthesis, Characterization, and Reactivity of Diacetylplatinum(II) and -platinum(IV) Complexes Bearing κ2- and κ3-Coordinated Scorpionate Ligands
• Authors of publication: Bette, Martin; Rüffer, Tobias; Bruhn, Clemens; Schmidt, Jürgen; Steinborn, Dirk
• Journal of publication: Organometallics
• Year of publication: 2012
• Journal volume: 31
• Journal issue: 9
• Pages of publication: 3700
• a: 9.7876 ± 0.0005 Å
• b: 16.6534 ± 0.0006 Å
• c: 11.7754 ± 0.0006 Å
• α: 90°
• β: 108.631 ± 0.004°
• γ: 90°
• Cell volume: 1818.77 ± 0.15 ų
• Cell temperature: 200 ± 2 K
• Ambient diffraction temperature: 200 ± 2 K
• Number of distinct elements: 7
• Space group number: 4
• Hermann-Mauguin space group symbol: P 1 21 1
• Hall space group symbol: P 2yb
• Residual factor for all reflections: 0.0316
• Residual factor for significantly intense reflections: 0.0279
• Weighted residual factors for significantly intense reflections: 0.0677
• Weighted residual factors for all reflections included in the refinement: 0.0687
• Goodness-of-fit parameter for all reflections included in the refinement: 0.974
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No