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Information card for entry 2019636
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| Coordinates | 2019636.cif |
|---|---|
| Structure factors | 2019636.hkl |
| Original IUCr paper | HTML |
| Common name | 2225 |
|---|---|
| Chemical name | ([2.2.2]Cryptand)potassium(I) bis(2,2'-bipyridine)cobaltate(‒I) anthrancene hemisolvate tetrahydrofuran disolvate |
| Formula | C53 H73 Co K N6 O8 |
| Calculated formula | C53 H73 Co K N6 O8 |
| Title of publication | Homoleptic 2,2'-bipyridine metalates(‒I) of iron and cobalt, one cocrystallized with an anthracene radical anion and the other with neutral anthracene |
| Authors of publication | Brennessel, William W.; Ellis, John E. |
| Journal of publication | Acta Crystallographica Section C |
| Year of publication | 2014 |
| Journal volume | 70 |
| Journal issue | 8 |
| Pages of publication | 828 - 832 |
| a | 10.5981 ± 0.0008 Å |
| b | 14.4323 ± 0.0011 Å |
| c | 18.4886 ± 0.0015 Å |
| α | 99.1054 ± 0.0013° |
| β | 90.8279 ± 0.0014° |
| γ | 109.243 ± 0.0013° |
| Cell volume | 2629.5 ± 0.4 Å3 |
| Cell temperature | 173 ± 2 K |
| Ambient diffraction temperature | 173 ± 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 | 0.0433 |
| Residual factor for significantly intense reflections | 0.031 |
| Weighted residual factors for significantly intense reflections | 0.0739 |
| Weighted residual factors for all reflections included in the refinement | 0.0786 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.031 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | Yes |
| Has Fobs | Yes |
| Revision | Date | Message | Files |
|---|---|---|---|
| 181866 (current) | 2016-04-06 | hkl/2/01/ (antanas@echidna) Adding IUCr specific svn headers to multiple entries in subrange 2/01/96. |
2019636.cif 2019636.hkl |
| 180864 | 2016-04-02 | cif/2/01/ (antanas@echidna) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 2/01/96. |
2019636.cif 2019636.hkl |
| 176760 | 2016-02-20 | cif/2/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 2/01. |
2019636.cif 2019636.hkl |
| 121044 | 2014-08-01 | cif/ hkl/ Adding structures of 2019635, 2019636 via cif-deposit CGI script. |
2019636.cif 2019636.hkl |
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Users of the data should acknowledge the original authors of the
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