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Information card for entry 7219603
Preview
| Coordinates | 7219603.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C21 H23 Cd2 N5 O12 |
|---|---|
| Calculated formula | C21 H23 Cd2 N5 O12 |
| Title of publication | A new Cd(ii)-based metal‒organic framework for highly sensitive fluorescence sensing of nitrobenzene |
| Authors of publication | Xia, Yu-Pei; Li, Yun-Wu; Li, Da-Cheng; Yao, Qing-Xia; Du, Yu-Chang; Dou, Jian-Min |
| Journal of publication | CrystEngComm |
| Year of publication | 2015 |
| Journal volume | 17 |
| Journal issue | 12 |
| Pages of publication | 2459 |
| a | 23.286 ± 0.002 Å |
| b | 17.2577 ± 0.0016 Å |
| c | 18.2221 ± 0.0017 Å |
| α | 90° |
| β | 126.661 ± 0.003° |
| γ | 90° |
| Cell volume | 5874.2 ± 1 Å3 |
| Cell temperature | 298 ± 2 K |
| Ambient diffraction temperature | 298 ± 2 K |
| Number of distinct elements | 5 |
| 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 | 0.1442 |
| Residual factor for significantly intense reflections | 0.0707 |
| Weighted residual factors for significantly intense reflections | 0.1428 |
| Weighted residual factors for all reflections included in the refinement | 0.1616 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.009 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 180527 (current) | 2016-03-26 | cif/7/21/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 7/21/96. |
7219603.cif |
| 134925 | 2015-04-06 | cif/ Updating files of 7219603 Original log message: Adding full bibliography for 7219603.cif. |
7219603.cif |
| 132040 | 2015-02-19 | cif/ Adding structures of 7219603 via cif-deposit CGI script. |
7219603.cif |
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Users of the data should acknowledge the original authors of the
structural data.