Information card for entry 4331883

Structure parameters

• Formula: C17 H25 N3 O2 Pt
• Calculated formula: C17 H25 N3 O2 Pt
• SMILES: [Pt]12([N](Cc3c2c(ccc3)C[N]1(C)C)(C)C)n1ccc(=O)cc1.O
• Title of publication: Hydroxy- and Mercaptopyridine Pincer Platinum and Palladium Complexes Generated by Silver-Free Halide Abstraction
• Authors of publication: Chuchuryukin, Alexey V.; Chase, Preston A.; Mills, Allison M.; Lutz, Martin; Spek, Anthony L.; van Klink, Gerard P. M.; van Koten, Gerard
• Journal of publication: Inorganic Chemistry
• Year of publication: 2006
• Journal volume: 45
• Journal issue: 5
• Pages of publication: 2045 - 2054
• a: 10.0702 ± 0.0003 Å
• b: 18.2011 ± 0.0004 Å
• c: 9.8155 ± 0.0002 Å
• α: 90°
• β: 90.7806 ± 0.0009°
• γ: 90°
• Cell volume: 1798.9 ± 0.08 ų
• Cell temperature: 150 ± 2 K
• Ambient diffraction temperature: 150 ± 2 K
• Number of distinct elements: 5
• 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: 0.0604
• Residual factor for significantly intense reflections: 0.0343
• Weighted residual factors for significantly intense reflections: 0.0633
• Weighted residual factors for all reflections included in the refinement: 0.0707
• Goodness-of-fit parameter for all reflections included in the refinement: 1.029
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No