Information card for entry 4073982

Structure parameters

• Formula: C21.5 H21 Cl3 N P Pt
• Calculated formula: C21.5 H21 Cl3 N P Pt
• Title of publication: P,N-Chelate Complexes of Pd(II) and Pt(II) Based on a Phosphaalkene Motif: A Catalyst for the Overman−Claisen Rearrangement
• Authors of publication: Dugal-Tessier, Julien; Dake, Gregory R.; Gates, Derek P.
• Journal of publication: Organometallics
• Year of publication: 2007
• Journal volume: 26
• Journal issue: 25
• Pages of publication: 6481
• a: 9.8721 ± 0.0007 Å
• b: 10.2072 ± 0.0007 Å
• c: 12.0467 ± 0.0008 Å
• α: 105.168 ± 0.006°
• β: 108.919 ± 0.005°
• γ: 95.834 ± 0.006°
• Cell volume: 1084.96 ± 0.14 ų
• Cell temperature: 173 ± 2 K
• Ambient diffraction temperature: 173 ± 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: 0.0285
• Residual factor for significantly intense reflections: 0.0259
• Weighted residual factors for significantly intense reflections: 0.0653
• Weighted residual factors for all reflections included in the refinement: 0.0662
• Goodness-of-fit parameter for all reflections included in the refinement: 1.09
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No