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Information card for entry 7239132
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Coordinates | 7239132.cif |
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Original paper (by DOI) | HTML |
Formula | C39 H38 N2 O8 S |
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Calculated formula | C39 H38 N2 O8 S |
Title of publication | Organocatalyzed aza-Michael‒Michael cascade reactions to construct spirooxindole tetrahydroquinolines with all-carbon chiral centers |
Authors of publication | Huang, You-ming; Zheng, Chang-wu; Zhao, Gang |
Journal of publication | RSC Advances |
Year of publication | 2013 |
Journal volume | 3 |
Journal issue | 38 |
Pages of publication | 16999 |
a | 17.7927 ± 0.0014 Å |
b | 11.1432 ± 0.0009 Å |
c | 18.4952 ± 0.0015 Å |
α | 90° |
β | 102.033 ± 0.002° |
γ | 90° |
Cell volume | 3586.4 ± 0.5 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 | 0.076 |
Residual factor for significantly intense reflections | 0.0572 |
Weighted residual factors for significantly intense reflections | 0.1375 |
Weighted residual factors for all reflections included in the refinement | 0.1512 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.019 |
Diffraction radiation wavelength | 0.71073 Å |
Diffraction radiation type | MoKα |
Has coordinates | Yes |
Has disorder | Yes |
Has Fobs | No |
Revision | Date | Message | Files |
---|---|---|---|
244564 (current) | 2019-11-28 | cif/ Adding structures of 7239132 via cif-deposit CGI script. |
7239132.cif |
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Users of the data should acknowledge the original authors of the
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