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Information card for entry 7238957
Preview
Coordinates | 7238957.cif |
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Original paper (by DOI) | HTML |
Formula | C27 H25 N O2 S |
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Calculated formula | C27 H25 N O2 S |
Title of publication | Three-component domino reactions providing rapid and efficient routes to fully substituted pyrroles |
Authors of publication | Liu, Jia-Yan; Li, Qiu-Yun; Jiang, Bo; Tu, Shu-Jiang |
Journal of publication | RSC Advances |
Year of publication | 2013 |
Journal volume | 3 |
Journal issue | 15 |
Pages of publication | 5056 |
a | 10.5132 ± 0.0011 Å |
b | 10.604 ± 0.0012 Å |
c | 22.086 ± 0.002 Å |
α | 78.682 ± 0.001° |
β | 84.544 ± 0.002° |
γ | 72.606 ± 0.001° |
Cell volume | 2302.2 ± 0.4 Å3 |
Cell temperature | 298 ± 2 K |
Ambient diffraction temperature | 298 ± 2 K |
Number of distinct elements | 5 |
Space group number | 2 |
Hermann-Mauguin space group symbol | P -1 |
Hall space group symbol | -P 1 |
Residual factor for all reflections | 0.1553 |
Residual factor for significantly intense reflections | 0.0656 |
Weighted residual factors for significantly intense reflections | 0.1345 |
Weighted residual factors for all reflections included in the refinement | 0.1522 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.041 |
Diffraction radiation wavelength | 0.71073 Å |
Diffraction radiation type | MoKα |
Has coordinates | Yes |
Has disorder | No |
Has Fobs | No |
Revision | Date | Message | Files |
---|---|---|---|
244477 (current) | 2019-11-28 | cif/ Adding structures of 7238956, 7238957, 7238958 via cif-deposit CGI script. |
7238957.cif |
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Users of the data should acknowledge the original authors of the
structural data.