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Information card for entry 4342345
Preview
| Coordinates | 4342345.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Common name | Manganese sulfonyldibenzoates |
|---|---|
| Formula | C64 H32 Mn4 N2 O26 S4 |
| Calculated formula | C64 H32 Mn4 N2 O26 S4 |
| Title of publication | High proton mobility, solvent induced single crystal to single crystal structural transformation, and related studies on a family of compounds formed from mn3 oxo-clusters. |
| Authors of publication | Bhattacharya, Saurav; Bhattacharyya, Aninda J.; Natarajan, Srinivasan |
| Journal of publication | Inorganic chemistry |
| Year of publication | 2015 |
| Journal volume | 54 |
| Journal issue | 4 |
| Pages of publication | 1254 - 1271 |
| a | 11.6384 ± 0.0018 Å |
| b | 21.052 ± 0.004 Å |
| c | 24.247 ± 0.004 Å |
| α | 114.959 ± 0.008° |
| β | 102.95 ± 0.009° |
| γ | 92.406 ± 0.009° |
| Cell volume | 5185.9 ± 1.6 Å3 |
| Cell temperature | 120 ± 2 K |
| Ambient diffraction temperature | 120 ± 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 | 0.128 |
| Residual factor for significantly intense reflections | 0.0761 |
| Weighted residual factors for significantly intense reflections | 0.2085 |
| Weighted residual factors for all reflections included in the refinement | 0.2283 |
| Goodness-of-fit parameter for all reflections included in the refinement | 0.936 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 179526 (current) | 2016-03-24 | cif/4/34/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 4/34/23. |
4342345.cif |
| 132787 | 2015-03-04 | cif/ Updating files of 4342345, 4342346, 4342347, 4342348, 4342349, 4342350, 4342351 Original log message: Adding full bibliography for 4342345--4342351.cif. |
4342345.cif |
| 131202 | 2015-02-06 | cif/ Adding structures of 4342345, 4342346, 4342347, 4342348, 4342349, 4342350, 4342351 via cif-deposit CGI script. |
4342345.cif |
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Users of the data should acknowledge the original authors of the
structural data.