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Information card for entry 7110178
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Coordinates | 7110178.cif |
---|---|
Original paper (by DOI) | HTML |
Chemical name | N-(4-bromobenzoyl)-2-methyl-5,5-diphenypiperidine |
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Formula | C25 H24 Br N O |
Calculated formula | C25 H24 Br N O |
SMILES | Brc1ccc(C(=O)N2CC(c3ccccc3)(c3ccccc3)CC[C@H]2C)cc1 |
Title of publication | A novel chiral yttrium complex with a tridentate linked amido-indenyl ligand for intramolecular hydroamination |
Authors of publication | Zhuo Chai; Dezhi Hua; Kui Li; Jiang Chu; Gaosheng Yang |
Journal of publication | Chem.Commun. |
Year of publication | 2014 |
Journal volume | 50 |
Pages of publication | 177 |
a | 8.7847 ± 0.0009 Å |
b | 12.8744 ± 0.0012 Å |
c | 9.3892 ± 0.0009 Å |
α | 90° |
β | 95.271 ± 0.001° |
γ | 90° |
Cell volume | 1057.41 ± 0.18 Å3 |
Cell temperature | 293 ± 2 K |
Ambient diffraction temperature | 293 ± 2 K |
Number of distinct elements | 5 |
Space group number | 4 |
Hermann-Mauguin space group symbol | P 1 21 1 |
Hall space group symbol | P 2yb |
Residual factor for all reflections | 0.0301 |
Residual factor for significantly intense reflections | 0.0247 |
Weighted residual factors for significantly intense reflections | 0.0735 |
Weighted residual factors for all reflections included in the refinement | 0.0784 |
Goodness-of-fit parameter for all reflections included in the refinement | 0.656 |
Diffraction radiation wavelength | 0.71073 Å |
Diffraction radiation type | MoKα |
Has coordinates | Yes |
Has disorder | No |
Has Fobs | No |
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