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Information card for entry 8102195
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| Coordinates | 8102195.cif |
|---|
| Chemical name | dibromo(N-ethyl-N'-pyridinylmethyleneethane-1,2-diamino)zinc(II), |
|---|---|
| Formula | C10 H15 Br2 N3 Zn |
| Calculated formula | C10 H15 Br2 N3 Zn |
| SMILES | [Zn]12(Br)(Br)[n]3c(C=[N]1CC[NH]2CC)cccc3 |
| Title of publication | Crystal structure of dibromo(N-ethyl-N'-pyridinylmethyleneethane-1, 2-diamino)zinc(II), ZnBr~2~(C~10~H~15~N~3~) |
| Authors of publication | Peng, San-Jun; Ping, Wei-Jun; Song, Liu-Bin |
| Journal of publication | Zeitschrift für Kristallographie - New Crystal Structures |
| Year of publication | 2007 |
| Journal volume | 222 |
| Journal issue | 4 |
| Pages of publication | 425 - 426 |
| a | 8.446 ± 0.003 Å |
| b | 8.561 ± 0.003 Å |
| c | 11.258 ± 0.003 Å |
| α | 111.791 ± 0.003° |
| β | 96.397 ± 0.002° |
| γ | 106.341 ± 0.003° |
| Cell volume | 703.7 ± 0.4 Å3 |
| Cell temperature | 293 ± 2 K |
| Ambient diffraction temperature | 293 ± 2 K |
| Number of distinct elements | 5 |
| Space group number | 2 |
| Hermann-Mauguin space group symbol | P -1 |
| Hall space group symbol | -P 1 |
| Residual factor for all reflections | 0.0451 |
| Residual factor for significantly intense reflections | 0.0328 |
| Weighted residual factors for significantly intense reflections | 0.0738 |
| Weighted residual factors for all reflections included in the refinement | 0.078 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.052 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| 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. |
8102195.cif |
| 108390 | 2014-03-31 | cif/8/ (antanas@lokys.ibt.lt) Adding and updating bibliographic information: volume, authors, issue, first page, last page. |
8102195.cif |
| 35911 | 2012-02-28 | cif/ Reorganising ranges 1, 3, 5, 6 and 8 into a prefix-directory tree. |
8102195.cif |
| 12934 | 2011-03-06 | ../uploads/cif-deposit/cod/cif Adding structures of 8102195 via cif-deposit CGI script. |
8102195.cif |
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Users of the data should acknowledge the original authors of the
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