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Information card for entry 2019674
Preview
| Coordinates | 2019674.cif |
|---|---|
| Structure factors | 2019674.hkl |
| Original IUCr paper | HTML |
| Chemical name | Poly[[(μ~4~-5-aminotetrazolato-\ κ^4^<i>N</i>^1^:<i>N</i>^2^:<i>N</i>^3^:<i>N</i>^4^:)chlorido-μ~3~-\ hydroxido-(μ~3~-isonicotinato-κ^3^<i>N</i>:<i>O</i>:<i>O</i>')dicadmium(II)] 0.14-hydrate] |
|---|---|
| Formula | C7 H7.28 Cd2 Cl N6 O3.14 |
| Calculated formula | C7 H7 Cd2 Cl N6 O3.142 |
| Title of publication | A pillared framework coordination polymer based on the Cd~3~(μ~3~-OH) unit: poly[[(μ~4~-5-aminotetrazolato-κ^4^<i>N</i>^1^:<i>N</i>^2^:<i>N</i>^3^:<i>N</i>^4^)chlorido-μ~3~-hydroxido-(μ~3~-isonicotinato-κ^3^<i>N</i>:<i>O</i>:<i>O</i>')dicadmium(II)] 0.14-hydrate] |
| Authors of publication | Wang, Yao; Guan, Ying-Fang; Liu, Jian-Jun; Huang, Chang-Cang |
| Journal of publication | Acta Crystallographica Section C |
| Year of publication | 2014 |
| Journal volume | 70 |
| Journal issue | 10 |
| Pages of publication | 983 - 986 |
| a | 19.479 ± 0.004 Å |
| b | 6.9971 ± 0.0014 Å |
| c | 13.235 ± 0.003 Å |
| α | 90° |
| β | 132.52 ± 0.03° |
| γ | 90° |
| Cell volume | 1329.5 ± 0.8 Å3 |
| Cell temperature | 293 ± 2 K |
| Ambient diffraction temperature | 293 ± 2 K |
| Number of distinct elements | 6 |
| Space group number | 12 |
| Hermann-Mauguin space group symbol | C 1 2/m 1 |
| Hall space group symbol | -C 2y |
| Residual factor for all reflections | 0.0184 |
| Residual factor for significantly intense reflections | 0.0169 |
| Weighted residual factors for significantly intense reflections | 0.039 |
| Weighted residual factors for all reflections included in the refinement | 0.0395 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.058 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | Yes |
| Revision | Date | Message | Files |
|---|---|---|---|
| 181866 (current) | 2016-04-06 | hkl/2/01/ (antanas@echidna) Adding IUCr specific svn headers to multiple entries in subrange 2/01/96. |
2019674.cif 2019674.hkl |
| 180864 | 2016-04-02 | cif/2/01/ (antanas@echidna) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 2/01/96. |
2019674.cif 2019674.hkl |
| 176760 | 2016-02-20 | cif/2/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 2/01. |
2019674.cif 2019674.hkl |
| 126179 | 2014-11-03 | cif/ Updating files of 2019674 Original log message: Adding full bibliography for 2019674.cif. |
2019674.cif 2019674.hkl |
| 124382 | 2014-09-30 | cif/ hkl/ Adding structures of 2019674 via cif-deposit CGI script. |
2019674.cif 2019674.hkl |
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Users of the data should acknowledge the original authors of the
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