Information card for entry 4079381

Structure parameters

• Formula: C57 H100 Cl8 P6 Pt2
• Calculated formula: C54 H94 P6 Pt2
• SMILES: [Pt]1([P]2(CC[P]31[C@@H](CC[C@H]3C)C)[C@@H](CC[C@H]2C)C)([P]1([C@@H](CC[C@H]1C)C)CC[P]1([Pt]2([P]3([C@@H](CC[C@H]3C)C)CC[P]32[C@@H](CC[C@H]3C)C)c2ccccc2)[C@@H](CC[C@H]1C)C)c1ccccc1
• Title of publication: Synthesis and Structure of Platinum Bis(phospholane) Complexes Pt(diphos*)(R)(X), Catalyst Precursors for Asymmetric Phosphine Alkylation
• Authors of publication: Guino-o, Marites A.; Zureick, Andrew H.; Blank, Natalia F.; Anderson, Brian J.; Chapp, Timothy W.; Kim, Youngmin; Glueck, David S.; Rheingold, Arnold L.
• Journal of publication: Organometallics
• Year of publication: 2012
• Journal volume: 31
• Journal issue: 19
• Pages of publication: 6900
• a: 10.7821 ± 0.0015 Å
• b: 21.19 ± 0.003 Å
• c: 29.56 ± 0.004 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 6753.7 ± 1.6 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 5
• Space group number: 19
• Hermann-Mauguin space group symbol: P 21 21 21
• Hall space group symbol: P 2ac 2ab
• Residual factor for all reflections: 0.0346
• Residual factor for significantly intense reflections: 0.0313
• Weighted residual factors for significantly intense reflections: 0.0699
• Weighted residual factors for all reflections included in the refinement: 0.071
• Goodness-of-fit parameter for all reflections included in the refinement: 1.048
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No