Information card for entry 4077973

Structure parameters

• Formula: C31 H50 Cl4 N2 O2 Pt
• Calculated formula: C31 H50 Cl4 N2 O2 Pt
• SMILES: [Pt]1(Cl)(Cl)[n]2cc(ccc2)COCCCCCCCCCCCCCCCCCCOCc2c[n]1ccc2.ClCCl
• Title of publication: Gyroscope-Like Platinum and Palladium Complexes with Trans-Spanning Bis(pyridine) Ligands
• Authors of publication: Zeits, Paul D.; Rachiero, Giovanni Pietro; Hampel, Frank; Reibenspies, Joseph H.; Gladysz, John A.
• Journal of publication: Organometallics
• Year of publication: 2012
• Journal volume: 31
• Journal issue: 7
• Pages of publication: 2854
• a: 8.91 ± 0.003 Å
• b: 9.003 ± 0.004 Å
• c: 24.747 ± 0.009 Å
• α: 87.55 ± 0.03°
• β: 87.042 ± 0.019°
• γ: 60.496 ± 0.016°
• Cell volume: 1725.1 ± 1.2 ų
• Cell temperature: 110 ± 2 K
• Ambient diffraction temperature: 110 ± 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: 0.0599
• Residual factor for significantly intense reflections: 0.0378
• Weighted residual factors for significantly intense reflections: 0.0826
• Weighted residual factors for all reflections included in the refinement: 0.0914
• Goodness-of-fit parameter for all reflections included in the refinement: 1.027
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No