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Information card for entry 7218510
Preview
| Coordinates | 7218510.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Common name | manganese(II)-benzenedisulfonate-dimethylacetamide |
|---|---|
| Formula | C14 H22 Mn N2 O8 S2 |
| Calculated formula | C14 H19.75 Mn N2 O8 S2 |
| Title of publication | 1,2,4,5-Benzenetetrasulfonic acid and 1,4-benzenedisulfonic acid as sulfo analogues of pyromellitic and terephthalic acids for building coordination polymers of manganese |
| Authors of publication | Zitzer, Christina; Muesmann, Thomas W. T.; Christoffers, Jens; Schwickert, Christian; Pöttgen, Rainer; Wickleder, Mathias S. |
| Journal of publication | CrystEngComm |
| Year of publication | 2014 |
| Journal volume | 16 |
| Journal issue | 48 |
| Pages of publication | 11064 |
| a | 9.36 ± 0.0004 Å |
| b | 9.8494 ± 0.0004 Å |
| c | 10.3475 ± 0.0005 Å |
| α | 81.606 ± 0.002° |
| β | 88.941 ± 0.002° |
| γ | 82.364 ± 0.002° |
| Cell volume | 935.35 ± 0.07 Å3 |
| Cell temperature | 120 ± 2 K |
| Ambient diffraction temperature | 120.15 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 | 0.0504 |
| Residual factor for significantly intense reflections | 0.0348 |
| Weighted residual factors for significantly intense reflections | 0.0939 |
| Weighted residual factors for all reflections included in the refinement | 0.1002 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.019 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | Yes |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 180516 (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 7/21/85. |
7218510.cif |
| 128354 | 2014-12-06 | cif/ Updating files of 7218507, 7218508, 7218509, 7218510, 7218511 Original log message: Adding full bibliography for 7218507--7218511.cif. |
7218510.cif |
| 125482 | 2014-10-17 | cif/ Adding structures of 7218507, 7218508, 7218509, 7218510, 7218511 via cif-deposit CGI script. |
7218510.cif |
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Users of the data should acknowledge the original authors of the
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