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Information card for entry 7018950
Preview
| Coordinates | 7018950.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C50 H50 B2 Co F2 N6 O8 |
|---|---|
| Calculated formula | C50 H50 B2 Co F2 N6 O8 |
| SMILES | [Co]12345[N]6O[B]7(F)O[N]2=C(C(=[N]3O[B](F)(O[N]1=C(OCCCC)C=6OCCCC)O[N]5=C(C(=[N]4O7)c1ccccc1)c1ccccc1)c1ccccc1)c1ccccc1.c1ccccc1.c1ccccc1 |
| Title of publication | Synthesis, structure, properties and immobilization on a gold surface of the monoribbed-functionalized tris-dioximate cobalt(ii) clathrochelates and an electrocatalytic hydrogen production from H+ ions |
| Authors of publication | Voloshin, Y. Z.; Belov, A. S.; Vologzhanina, A. V.; Aleksandrov, G. G.; Dolganov, A. V.; Novikov, V. V.; Varzatskii, O. A.; Bubnov, Y. N. |
| Journal of publication | Dalton Transactions |
| Year of publication | 2012 |
| Journal volume | 41 |
| Journal issue | 20 |
| Pages of publication | 6078 |
| a | 12.3008 ± 0.0012 Å |
| b | 14.607 ± 0.002 Å |
| c | 26.589 ± 0.004 Å |
| α | 90° |
| β | 90° |
| γ | 90° |
| Cell volume | 4777.5 ± 1.1 Å3 |
| Cell temperature | 100 ± 2 K |
| Ambient diffraction temperature | 100 ± 2 K |
| Number of distinct elements | 7 |
| Space group number | 19 |
| Hermann-Mauguin space group symbol | P 21 21 21 |
| Hall space group symbol | P 2ac 2ab |
| Residual factor for all reflections | 0.0805 |
| Residual factor for significantly intense reflections | 0.0474 |
| Weighted residual factors for significantly intense reflections | 0.0741 |
| Weighted residual factors for all reflections included in the refinement | 0.0844 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.034 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 179893 (current) | 2016-03-25 | cif/7/01/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 7/01/89. |
7018950.cif |
| 120112 | 2014-07-12 | Adding DOIs to range 7 structures. | 7018950.cif |
| 56004 | 2012-05-08 | cif/ Adding structures of 7018946, 7018947, 7018948, 7018949, 7018950, 7018951 via cif-deposit CGI script. |
7018950.cif |
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Users of the data should acknowledge the original authors of the
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