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Information card for entry 7121948
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Coordinates | 7121948.cif |
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Original paper (by DOI) | HTML |
Formula | C22 H22 N2 O Pd S |
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Calculated formula | C22 H22 N2 O Pd S |
Title of publication | Palladium-catalyzed C(carbonyl)-C bond cleavage of amides: a facile access to phenylcarbamate derivatives with alcohols. |
Authors of publication | Yan, Xufei; Sun, Huihui; Xiang, Haifeng; Yu, Da-Gang; Luo, Daibing; Zhou, Xiangge |
Journal of publication | Chemical communications (Cambridge, England) |
Year of publication | 2018 |
Journal volume | 54 |
Journal issue | 62 |
Pages of publication | 8606 - 8609 |
a | 9.4594 ± 0.0003 Å |
b | 11.2077 ± 0.0004 Å |
c | 19.4065 ± 0.0006 Å |
α | 90° |
β | 90° |
γ | 90° |
Cell volume | 2057.44 ± 0.12 Å3 |
Cell temperature | 293 ± 2 K |
Ambient diffraction temperature | 293.15 K |
Number of distinct elements | 6 |
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 | 0.0522 |
Residual factor for significantly intense reflections | 0.0356 |
Weighted residual factors for significantly intense reflections | 0.0744 |
Weighted residual factors for all reflections included in the refinement | 0.0825 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.035 |
Diffraction radiation probe | x-ray |
Diffraction radiation wavelength | 0.71073 Å |
Diffraction radiation type | MoKα |
Has coordinates | Yes |
Has disorder | No |
Has Fobs | No |
Revision | Date | Message | Files |
---|---|---|---|
228473 (current) | 2019-11-17 | cif/ Updating files of 7121947, 7121948 Original log message: Adding full bibliography for 7121947--7121948.cif. |
7121948.cif |
208956 | 2018-07-11 | cif/ Adding structures of 7121947, 7121948 via cif-deposit CGI script. |
7121948.cif |
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