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Information card for entry 7119255
Preview
Coordinates | 7119255.cif |
---|---|
Original paper (by DOI) | HTML |
Formula | C30 H28 Cl2 N Ni O P |
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Calculated formula | C30 H28 Cl2 N Ni O P |
SMILES | [Ni]1([P](c2ccccc2)(c2c(cccc2)c2c(C3=[N]1[C@H](CO3)C(C)C)cccc2)c1ccccc1)(Cl)Cl |
Title of publication | Ni(ii)-catalyzed asymmetric addition of arylboronic acids to cyclic imines. |
Authors of publication | Quan, Mao; Tang, Liang; Shen, Jiaqi; Yang, Guoqiang; Zhang, Wanbin |
Journal of publication | Chemical communications (Cambridge, England) |
Year of publication | 2017 |
Journal volume | 53 |
Journal issue | 3 |
Pages of publication | 609 - 612 |
a | 10.1361 ± 0.0003 Å |
b | 20.7607 ± 0.0008 Å |
c | 14.8742 ± 0.0007 Å |
α | 90° |
β | 90° |
γ | 90° |
Cell volume | 3130 ± 0.2 Å3 |
Cell temperature | 293 ± 2 K |
Ambient diffraction temperature | 293.15 K |
Number of distinct elements | 7 |
Space group number | 18 |
Hermann-Mauguin space group symbol | P 21 21 2 |
Hall space group symbol | P 2 2ab |
Residual factor for all reflections | 0.0461 |
Residual factor for significantly intense reflections | 0.0364 |
Weighted residual factors for significantly intense reflections | 0.086 |
Weighted residual factors for all reflections included in the refinement | 0.0916 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.026 |
Diffraction radiation wavelength | 0.71073 Å |
Diffraction radiation type | MoKα |
Has coordinates | Yes |
Has disorder | No |
Has Fobs | No |
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