Information card for entry 7038612

Structure parameters

• Formula: C34 H48 B F4 N O P Rh
• Calculated formula: C34 H48 B F4 N O P Rh
• SMILES: [Rh]1234([P@@]([C@@H](c5ccccc5)C(C5OC[C@@H]([N]1=5)C(C)C)(C)C)(c1c(C)cc(cc1C)C)C)[CH]1CC[CH]2=[CH]3CC[CH]4=1.[B](F)(F)(F)[F-]
• Title of publication: Phosphaalkene-oxazoline copolymers with styrene as chiral ligands for rhodium(i).
• Authors of publication: Serin, Spencer C.; Dake, Gregory R.; Gates, Derek P.
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2016
• Journal volume: 45
• Journal issue: 13
• Pages of publication: 5659 - 5666
• a: 10.0034 ± 0.0005 Å
• b: 17.8518 ± 0.0009 Å
• c: 17.9626 ± 0.0009 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 3207.7 ± 0.3 ų
• Cell temperature: 90 ± 2 K
• Ambient diffraction temperature: 90 ± 2 K
• Number of distinct elements: 8
• 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: 0.0309
• Residual factor for significantly intense reflections: 0.0268
• Weighted residual factors for significantly intense reflections: 0.056
• Weighted residual factors for all reflections included in the refinement: 0.0578
• Goodness-of-fit parameter for all reflections included in the refinement: 1.042
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No