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Information card for entry 8102109
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| Coordinates | 8102109.cif |
|---|
| Chemical name | diaqua-bis(2,5-bis(2-pyridyl)-1,3,4-thiadiazole)cobalt(II) diperchlorate dihydrate 2,5-bis(2-pyridyl)-1,3,4-thiadiazole monosolvate |
|---|---|
| Formula | C36 H32 Cl2 Co N12 O12 S3 |
| Calculated formula | C36 H32 Cl2 Co N12 O12 S3 |
| Title of publication | Crystal structure of diaqua-bis(2,5-bis(2-pyridyl)-1,3,4-thiadiazole)- cobalt(II) diperchlorate 2,5-bis(2-pyridyl)-1,3,4-thiadiazole monosolvate dihydrate, [Co(H~2~O)~2~(C~12~H~8~N~4~S)~2~][ClO~4~]~2~ · C~12~H~8~N~4~S · 2H~2~O |
| Authors of publication | Wan, X.-S.; Ning, A.-M.; Hou, S.-C.; Niu, C.-Y.; Kou, C.-H.; Dang, Y.-L. |
| Journal of publication | Zeitschrift für Kristallographie - New Crystal Structures |
| Year of publication | 2007 |
| Journal volume | 222 |
| Journal issue | 2 |
| Pages of publication | 153 - 154 |
| a | 9.82 ± 0.002 Å |
| b | 10.806 ± 0.002 Å |
| c | 11.12 ± 0.002 Å |
| α | 74.198 ± 0.002° |
| β | 82.053 ± 0.002° |
| γ | 69.88 ± 0.002° |
| Cell volume | 1064.8 ± 0.4 Å3 |
| Cell temperature | 291 ± 2 K |
| Ambient diffraction temperature | 291 ± 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 | 0.1236 |
| Residual factor for significantly intense reflections | 0.1059 |
| Weighted residual factors for significantly intense reflections | 0.2726 |
| Weighted residual factors for all reflections included in the refinement | 0.2889 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.853 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | Yes |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 176728 (current) | 2016-02-18 | cif/ (antanas@echidna.ibt.lt) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in range 8. |
8102109.cif |
| 108257 | 2014-03-29 | cif/8/ (antanas@lokys.ibt.lt) Adding and updating bibliographic information: volume, authors, issue, first page, last page. |
8102109.cif |
| 108108 | 2014-03-27 | cif/8/ (antanas@lokys.ibt.lt) Removing some extra characters introduced while converting CIF's from one encoding into the other. |
8102109.cif |
| 35911 | 2012-02-28 | cif/ Reorganising ranges 1, 3, 5, 6 and 8 into a prefix-directory tree. |
8102109.cif |
| 12848 | 2011-03-06 | ../uploads/cif-deposit/cod/cif Adding structures of 8102109 via cif-deposit CGI script. |
8102109.cif |
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