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Information card for entry 7207384
Preview
| Coordinates | 7207384.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C36 H38 Co2 N6 O13 |
|---|---|
| Calculated formula | C33 H25 Co2 N5 O9 |
| Title of publication | Two pillared-layer metal‒organic frameworks constructed with Co(ii), 1,2,4,5-benzenetetracarboxylate, and 4,4′-bipyridine: syntheses, crystal structures, and gas adsorption properties |
| Authors of publication | Song, Ping; Liu, Bin; Li, Yaoqi; Yang, Junzhi; Wang, Zheming; Li, Xingguo |
| Journal of publication | CrystEngComm |
| Year of publication | 2012 |
| Journal volume | 14 |
| Journal issue | 6 |
| Pages of publication | 2296 |
| a | 8.8102 ± 0.0002 Å |
| b | 15.6323 ± 0.0004 Å |
| c | 16.3592 ± 0.0004 Å |
| α | 103.544 ± 0.001° |
| β | 100.811 ± 0.001° |
| γ | 90.1909 ± 0.0012° |
| Cell volume | 2148.88 ± 0.09 Å3 |
| Cell temperature | 290 K |
| Ambient diffraction temperature | 290 K |
| Number of distinct elements | 5 |
| Space group number | 2 |
| Hermann-Mauguin space group symbol | P -1 |
| Hall space group symbol | -P 1 |
| Residual factor for all reflections | 0.083 |
| Residual factor for significantly intense reflections | 0.0431 |
| Weighted residual factors for significantly intense reflections | 0.107 |
| Weighted residual factors for all reflections included in the refinement | 0.1155 |
| Goodness-of-fit parameter for all reflections included in the refinement | 0.924 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | Yes |
| 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. |
7207384.cif |
| 180404 | 2016-03-26 | cif/7/20/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 7/20/73. |
7207384.cif |
| 120112 | 2014-07-12 | Adding DOIs to range 7 structures. | 7207384.cif |
| 37628 | 2012-03-04 | ../uploads/cif-deposit/cod/cif Adding structures of 7207384, 7207385 via cif-deposit CGI script. |
7207384.cif |
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Users of the data should acknowledge the original authors of the
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