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Information card for entry 7158012
Preview
Coordinates | 7158012.cif |
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Original paper (by DOI) | HTML |
Formula | C23 H22 Br2 O6 |
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Calculated formula | C23 H22 Br2 O6 |
Title of publication | Selectfluor facilitated bridging of indoles to bis(indolyl)methanes using methyl <i>tert</i>-butyl ether as a new methylene precursor. |
Authors of publication | Jin, Jiang; Li, Yinghua; Xiang, Shiqun; Fan, Weibin; Guo, Shiwei; Huang, Deguang |
Journal of publication | Organic & biomolecular chemistry |
Year of publication | 2021 |
Journal volume | 19 |
Journal issue | 18 |
Pages of publication | 4076 - 4081 |
a | 19.6128 ± 0.0009 Å |
b | 12.3072 ± 0.0006 Å |
c | 9.3607 ± 0.0005 Å |
α | 90° |
β | 90° |
γ | 90° |
Cell volume | 2259.47 ± 0.19 Å3 |
Cell temperature | 150 ± 2 K |
Ambient diffraction temperature | 150 ± 2 K |
Number of distinct elements | 4 |
Space group number | 33 |
Hermann-Mauguin space group symbol | P n a 21 |
Hall space group symbol | P 2c -2n |
Residual factor for all reflections | 0.0421 |
Residual factor for significantly intense reflections | 0.038 |
Weighted residual factors for significantly intense reflections | 0.1015 |
Weighted residual factors for all reflections included in the refinement | 0.1054 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.047 |
Diffraction radiation wavelength | 1.54184 Å |
Diffraction radiation type | CuKα |
Has coordinates | Yes |
Has disorder | Yes |
Has Fobs | No |
Revision | Date | Message | Files |
---|---|---|---|
266172 (current) | 2021-06-05 | cif/ Updating files of 7158011, 7158012, 7158013, 7158014, 7158015 Original log message: Adding full bibliography for 7158011--7158015.cif. |
7158012.cif |
263963 | 2021-04-08 | cif/ Adding structures of 7158011, 7158012, 7158013, 7158014, 7158015 via cif-deposit CGI script. |
7158012.cif |
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Users of the data should acknowledge the original authors of the
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