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Information card for entry 7225284
Preview
| Coordinates | 7225284.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C48 H40 Cu2 Mo8 N16 O26 |
|---|---|
| Calculated formula | C48 H40 Cu2 Mo8 N16 O26 |
| Title of publication | pH-Dependent assembly of three novel inorganic‒organic hybrids based on different isopolymolybdates and CuI/II(bbx)nunits |
| Authors of publication | Wu, Panfeng; Xue, Qi; Dong, Xinbo; Zhang, Yanjie; Liu, Bin; Hu, Huaiming; Xue, Ganglin |
| Journal of publication | CrystEngComm |
| Year of publication | 2016 |
| Journal volume | 18 |
| Journal issue | 28 |
| Pages of publication | 5320 |
| a | 12.795 ± 0.003 Å |
| b | 17.242 ± 0.004 Å |
| c | 16.094 ± 0.004 Å |
| α | 90° |
| β | 111.687 ± 0.004° |
| γ | 90° |
| Cell volume | 3299.2 ± 1.4 Å3 |
| Cell temperature | 296 ± 2 K |
| Ambient diffraction temperature | 296 ± 2 K |
| Number of distinct elements | 6 |
| Space group number | 14 |
| Hermann-Mauguin space group symbol | P 1 21/n 1 |
| Hall space group symbol | -P 2yn |
| Residual factor for all reflections | 0.0614 |
| Residual factor for significantly intense reflections | 0.0385 |
| Weighted residual factors for significantly intense reflections | 0.0871 |
| Weighted residual factors for all reflections included in the refinement | 0.0973 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.023 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 198633 (current) | 2017-07-11 | cod/ (melanie@ameba.ibt.lt) Correcting the '_refine_ls_hydrogen_treatment' data item 'constr' enumeration values with the help of the cif_fix_values script from the cod-tools package revision 5455. The following command was used : cif_fix_values --fix-misspelled src/cod-tools/trunk/data/replacement-values/replacement_values.lst $i | cif_filter --no-exclude-publication-details -h $i | sponge $i A total of 700 files were changed. |
7225284.cif |
| 185270 | 2016-08-07 | cif/ Updating files of 7225284, 7225285, 7225286 Original log message: Adding full bibliography for 7225284--7225286.cif. |
7225284.cif |
| 183036 | 2016-05-20 | cif/ Adding structures of 7225284, 7225285, 7225286 via cif-deposit CGI script. |
7225284.cif |
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Users of the data should acknowledge the original authors of the
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