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Information card for entry 7216487
Preview
| Coordinates | 7216487.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Chemical name | [(±)-2,7,12-tripropoxy-3,8,13-tris(4-pyridylcarboxy)-10,15- dihydro-5H-tribenzo[a,d,g]cyclononene]silver (I) cobalt(III) bis(dicarbollide) hydrate dimethylformamide |
|---|---|
| Formula | C59.5 H86.5 Ag B18 Co N5.5 O12.5 |
| Calculated formula | C59.5 H84.5 Ag B18 Co N5.5 O12.5 |
| Title of publication | Tuning the coordination chemistry of cyclotriveratrylene ligand pairs through alkyl chain aggregation |
| Authors of publication | Henkelis, James J.; Hardie, Michaele J. |
| Journal of publication | CrystEngComm |
| Year of publication | 2014 |
| Journal volume | 16 |
| Journal issue | 35 |
| Pages of publication | 8138 |
| a | 10.324 ± 0.003 Å |
| b | 18.828 ± 0.005 Å |
| c | 21.852 ± 0.006 Å |
| α | 69.016 ± 0.006° |
| β | 84.428 ± 0.01° |
| γ | 75.039 ± 0.01° |
| Cell volume | 3831.4 ± 1.9 Å3 |
| Cell temperature | 100 ± 2 K |
| Ambient diffraction temperature | 100 ± 2 K |
| Number of distinct elements | 7 |
| Space group number | 2 |
| Hermann-Mauguin space group symbol | P -1 |
| Hall space group symbol | -P 1 |
| Residual factor for all reflections | 0.0885 |
| Residual factor for significantly intense reflections | 0.0807 |
| Weighted residual factors for significantly intense reflections | 0.2334 |
| Weighted residual factors for all reflections included in the refinement | 0.2426 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.069 |
| Diffraction radiation wavelength | 0.6889 Å |
| Diffraction radiation type | synchrotron |
| Has coordinates | Yes |
| Has disorder | Yes |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 176453 (current) | 2016-02-16 | cif/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in range 7. |
7216487.cif |
| 123384 | 2014-09-08 | cif/ Updating files of 7216487, 7216488, 7216489, 7216490 Original log message: Adding full bibliography for 7216487--7216490.cif. |
7216487.cif |
| 116413 | 2014-06-11 | cif/ Adding structures of 7216487, 7216488, 7216489, 7216490 via cif-deposit CGI script. |
7216487.cif |
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Users of the data should acknowledge the original authors of the
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