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Information card for entry 4030671
Preview
| Coordinates | 4030671.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C30 H24 Br Cl2 N3 O5 |
|---|---|
| Calculated formula | C30 H24 Br Cl2 N3 O5 |
| Title of publication | Visible Light Mediated Cyclization of Tertiary Anilines with Maleimides Using Nickel(II) Oxide Surface-Modified Titanium Dioxide Catalyst. |
| Authors of publication | Tang, Jian; Grampp, Günter; Liu, Yun; Wang, Bing-Xiang; Tao, Fei-Fei; Wang, Li-Jun; Liang, Xue-Zheng; Xiao, Hui-Quan; Shen, Yong-Miao |
| Journal of publication | The Journal of organic chemistry |
| Year of publication | 2015 |
| Journal volume | 80 |
| Journal issue | 5 |
| Pages of publication | 2724 - 2732 |
| a | 7.595 ± 0.0004 Å |
| b | 13.7694 ± 0.0008 Å |
| c | 15.7113 ± 0.0012 Å |
| α | 64.051 ± 0.002° |
| β | 88.667 ± 0.003° |
| γ | 76.613 ± 0.002° |
| Cell volume | 1431.54 ± 0.16 Å3 |
| Cell temperature | 173 ± 2 K |
| Ambient diffraction temperature | 173 ± 2 K |
| Number of distinct elements | 6 |
| Space group number | 2 |
| Hermann-Mauguin space group symbol | P -1 |
| Hall space group symbol | -P 1 |
| Residual factor for all reflections | 0.0664 |
| Residual factor for significantly intense reflections | 0.0421 |
| Weighted residual factors for significantly intense reflections | 0.102 |
| Weighted residual factors for all reflections included in the refinement | 0.1105 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.015 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | Yes |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 178485 (current) | 2016-03-21 | cif/4/03/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 4/03/06. |
4030671.cif |
| 134841 | 2015-04-04 | cif/ Updating files of 4030670, 4030671, 4030672 Original log message: Adding full bibliography for 4030670--4030672.cif. |
4030671.cif |
| 131727 | 2015-02-12 | cif/ Adding structures of 4030671 via cif-deposit CGI script. |
4030671.cif |
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Users of the data should acknowledge the original authors of the
structural data.