Information card for entry 1559351

Structure parameters

• Formula: C29 H27 Cl3 N2 O2 Pt
• Calculated formula: C29 H27 Cl3 N2 O2 Pt
• Title of publication: Visible light driven generation and alkyne insertion reactions of stable bis-cyclometalated Pt(IV) hydrides
• Authors of publication: Poveda, Dionisio; Vivancos, Angela; Bautista, Delia; González-Herrero, Pablo
• Journal of publication: Chemical Science
• Year of publication: 2020
• a: 16.5931 ± 0.0012 Å
• b: 10.5622 ± 0.0008 Å
• c: 15.6839 ± 0.0012 Å
• α: 90°
• β: 91.297 ± 0.003°
• γ: 90°
• Cell volume: 2748.1 ± 0.4 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 6
• 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: 0.0379
• Residual factor for significantly intense reflections: 0.0263
• Weighted residual factors for significantly intense reflections: 0.0581
• Weighted residual factors for all reflections included in the refinement: 0.0622
• Goodness-of-fit parameter for all reflections included in the refinement: 1.046
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No