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Information card for entry 8102094
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| Coordinates | 8102094.cif |
|---|
| Chemical name | tetraaqua-bis(4,4'-bipyridine)-cobalt(II) bis(2,2'-hydrogendithiodibenzoate) |
|---|---|
| Formula | C48 H42 Co N4 O12 S4 |
| Calculated formula | C48 H42 Co N4 O12 S4 |
| Title of publication | Crystal structure of tetraaqua-bis(4,4'-bipyridine)-cobalt(II) bis (2,2'-hydrogendithiodibenzoate), [Co(H~2~O)~4~(C~10~H~8~N~2~)~2~] [C~14~H~9~O~4~S~2~]~2~ |
| Authors of publication | Li, X.-H.; Lu, J.-L.; Jalbout, A. F. |
| Journal of publication | Zeitschrift für Kristallographie - New Crystal Structures |
| Year of publication | 2007 |
| Journal volume | 222 |
| Journal issue | 2 |
| Pages of publication | 114 - 116 |
| a | 7.7278 ± 0.0011 Å |
| b | 10.9679 ± 0.0016 Å |
| c | 14.092 ± 0.002 Å |
| α | 71.003 ± 0.002° |
| β | 88.221 ± 0.003° |
| γ | 80.503 ± 0.003° |
| Cell volume | 1113.5 ± 0.3 Å3 |
| Cell temperature | 298 ± 2 K |
| Ambient diffraction temperature | 298 ± 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 | 0.1273 |
| Residual factor for significantly intense reflections | 0.103 |
| Weighted residual factors for significantly intense reflections | 0.191 |
| Weighted residual factors for all reflections included in the refinement | 0.2023 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.24 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 176432 (current) | 2016-02-14 | cif/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries. |
8102094.cif |
| 108257 | 2014-03-29 | cif/8/ (antanas@lokys.ibt.lt) Adding and updating bibliographic information: volume, authors, issue, first page, last page. |
8102094.cif |
| 35911 | 2012-02-28 | cif/ Reorganising ranges 1, 3, 5, 6 and 8 into a prefix-directory tree. |
8102094.cif |
| 12833 | 2011-03-06 | ../uploads/cif-deposit/cod/cif Adding structures of 8102094 via cif-deposit CGI script. |
8102094.cif |
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Users of the data should acknowledge the original authors of the
structural data.