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Information card for entry 7239313
Preview
Coordinates | 7239313.cif |
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Original paper (by DOI) | HTML |
Formula | C30.5 H24 Cl N O S |
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Calculated formula | C30.5 H24 Cl N O S |
Title of publication | Diastereoselective synthesis of polysubstituted Δ1-pyrroline derivatives from in situ generated nitrile ylides |
Authors of publication | Guo, Zhi-Wei; Huang, Xiao; Mao, Jia-Min; Zhu, Wei-Dong; Xie, Jian-Wu |
Journal of publication | RSC Advances |
Year of publication | 2013 |
Journal volume | 3 |
Journal issue | 47 |
Pages of publication | 25103 |
a | 39.108 ± 0.004 Å |
b | 8.1605 ± 0.0008 Å |
c | 16.4308 ± 0.0015 Å |
α | 90° |
β | 111.789 ± 0.008° |
γ | 90° |
Cell volume | 4869.1 ± 0.9 Å3 |
Cell temperature | 293 ± 2 K |
Ambient diffraction temperature | 293 ± 2 K |
Number of distinct elements | 6 |
Space group number | 15 |
Hermann-Mauguin space group symbol | C 1 2/c 1 |
Hall space group symbol | -C 2yc |
Residual factor for all reflections | 0.0767 |
Residual factor for significantly intense reflections | 0.0463 |
Weighted residual factors for significantly intense reflections | 0.1272 |
Weighted residual factors for all reflections included in the refinement | 0.1416 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.125 |
Diffraction radiation wavelength | 0.71073 Å |
Diffraction radiation type | MoKα |
Has coordinates | Yes |
Has disorder | No |
Has Fobs | No |
Revision | Date | Message | Files |
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244647 (current) | 2019-11-28 | cif/ Adding structures of 7239310, 7239311, 7239312, 7239313 via cif-deposit CGI script. |
7239313.cif |
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Users of the data should acknowledge the original authors of the
structural data.