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Information card for entry 7216355
Preview
| Coordinates | 7216355.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C8 H8 As N3 O3 |
|---|---|
| Calculated formula | C8 H8 As N3 O3 |
| Title of publication | Exploring the coordination chemistry of bifunctional organoarsonate ligands: syntheses and characterisation of coordination polymers that contain 4-(1,2,4-triazol-4-yl)phenylarsonic acid |
| Authors of publication | Lin, Jian-Di; Clérac, Rodolphe; Rouzières, Mathieu; Venkatesan, Munuswamy; Chimamkpam, Theresa O.; Schmitt, Wolfgang |
| Journal of publication | CrystEngComm |
| Year of publication | 2014 |
| Journal volume | 16 |
| Journal issue | 34 |
| Pages of publication | 7894 |
| a | 6.012 ± 0.0009 Å |
| b | 21.594 ± 0.003 Å |
| c | 8.9646 ± 0.0009 Å |
| α | 90° |
| β | 126.135 ± 0.007° |
| γ | 90° |
| Cell volume | 939.9 ± 0.2 Å3 |
| Cell temperature | 100 ± 2 K |
| Ambient diffraction temperature | 100 ± 2 K |
| Number of distinct elements | 5 |
| Space group number | 14 |
| Hermann-Mauguin space group symbol | P 1 21/c 1 |
| Hall space group symbol | -P 2ybc |
| Residual factor for all reflections | 0.0601 |
| Residual factor for significantly intense reflections | 0.0593 |
| Weighted residual factors for significantly intense reflections | 0.1344 |
| Weighted residual factors for all reflections included in the refinement | 0.1348 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.078 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | Yes |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 180494 (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 7/21/63. |
7216355.cif |
| 121607 | 2014-08-08 | cif/ Updating files of 7216351, 7216352, 7216353, 7216354, 7216355, 7216356 Original log message: Adding full bibliography for 7216351--7216356.cif. |
7216355.cif |
| 115571 | 2014-06-04 | cif/ Adding structures of 7216351, 7216352, 7216353, 7216354, 7216355, 7216356 via cif-deposit CGI script. |
7216355.cif |
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Users of the data should acknowledge the original authors of the
structural data.