Information card for entry 7155032

Structure parameters

• Formula: C31 H32 N O3 Rh
• Calculated formula: C31 H32 N O3 Rh
• SMILES: [Rh]123(OC(=CC(=[O]1)C)C)[N]1=C(OC[C@@]1(C[CH]2=[CH2]3)Cc1ccccc1)C(c1ccccc1)c1ccccc1
• Title of publication: Two phenyls are better than one or three: synthesis and application of terminal olefin-oxazoline (TOlefOx) ligands.
• Authors of publication: Zhao, Yi-Shuang; Liu, Jian-Kang; He, Zhi-Tao; Tao, Jing-Chao; Tian, Ping; Lin, Guo-Qiang
• Journal of publication: Organic & biomolecular chemistry
• Year of publication: 2016
• Journal volume: 14
• Journal issue: 15
• Pages of publication: 3686 - 3689
• a: 9.7915 ± 0.0007 Å
• b: 10.0496 ± 0.0006 Å
• c: 33.148 ± 0.002 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 3261.8 ± 0.4 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 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: 0.0499
• Residual factor for significantly intense reflections: 0.0419
• Weighted residual factors for significantly intense reflections: 0.0963
• Weighted residual factors for all reflections included in the refinement: 0.1004
• Goodness-of-fit parameter for all reflections included in the refinement: 1.021
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No