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Information card for entry 1554385
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Coordinates | 1554385.cif |
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Original paper (by DOI) | HTML |
Formula | C54 H53 Mg N2 |
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Calculated formula | C54 H53 Mg N2 |
Title of publication | Unsymmetrical β-diketiminate magnesium(i) complexes: syntheses and application in catalytic hydroboration of alkyne, nitrile and carbonyl compounds |
Authors of publication | Li, Jia; Luo, Man; Sheng, Xingchao; Hua, Haiming; Yao, Weiwei; Pullarkat, Sumod A.; Xu, Li; Ma, Mengtao |
Journal of publication | Organic Chemistry Frontiers |
Year of publication | 2018 |
Journal volume | 5 |
Journal issue | 24 |
Pages of publication | 3538 |
a | 11.4271 ± 0.0014 Å |
b | 17.954 ± 0.002 Å |
c | 20.908 ± 0.003 Å |
α | 90° |
β | 93.495 ± 0.003° |
γ | 90° |
Cell volume | 4281.6 ± 0.9 Å3 |
Cell temperature | 130 ± 2 K |
Ambient diffraction temperature | 130 ± 2 K |
Number of distinct elements | 4 |
Space group number | 14 |
Hermann-Mauguin space group symbol | P 1 21/c 1 |
Hall space group symbol | -P 2ybc |
Residual factor for all reflections | 0.0857 |
Residual factor for significantly intense reflections | 0.0559 |
Weighted residual factors for significantly intense reflections | 0.1467 |
Weighted residual factors for all reflections included in the refinement | 0.1664 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.023 |
Diffraction radiation wavelength | 0.71073 Å |
Diffraction radiation type | MoKα |
Has coordinates | Yes |
Has disorder | No |
Has Fobs | No |
Revision | Date | Message | Files |
---|---|---|---|
237180 (current) | 2019-11-24 | cif/ Adding structures of 1554381, 1554382, 1554383, 1554384, 1554385, 1554386, 1554387, 1554388, 1554389, 1554390, 1554391 via cif-deposit CGI script. |
1554385.cif |
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Users of the data should acknowledge the original authors of the
structural data.