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Information card for entry 7052670
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| Coordinates | 7052670.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Common name | N,N-diethyl-1,3-propanediamine biphenyldithiolate cadmium(ii) |
|---|---|
| Chemical name | N,N-diethyl-1,3-propanediamine biphenyldithiolate cadmium(II) |
| Formula | C19 H26 Cd N2 S2 |
| Calculated formula | C19 H26 Cd N2 S2 |
| Title of publication | Thermodynamically controlled coordination-engineering of novel 2D cadmium thiolate coordination polymers |
| Authors of publication | Louvain, Nicolas; Takashima, Yohei; Kitagawa, Susumu; Furukawa, Shuhei |
| Journal of publication | New Journal of Chemistry |
| Year of publication | 2011 |
| Journal volume | 35 |
| Journal issue | 6 |
| Pages of publication | 1265 |
| a | 8.2439 ± 0.0003 Å |
| b | 21.1076 ± 0.0009 Å |
| c | 22.4715 ± 0.0008 Å |
| α | 90° |
| β | 90° |
| γ | 90° |
| Cell volume | 3910.2 ± 0.3 Å3 |
| Cell temperature | 93.15 K |
| Ambient diffraction temperature | 93.15 K |
| Number of distinct elements | 5 |
| Space group number | 61 |
| Hermann-Mauguin space group symbol | P b c a |
| Hall space group symbol | -P 2ac 2ab |
| Residual factor for all reflections | 0.032 |
| Residual factor for significantly intense reflections | 0.0285 |
| Weighted residual factors for significantly intense reflections | 0.0638 |
| Weighted residual factors for all reflections included in the refinement | 0.0657 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.161 |
| Diffraction radiation probe | x-ray |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 180080 (current) | 2016-03-26 | cif/7/05/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 7/05/26. |
7052670.cif |
| 120112 | 2014-07-12 | Adding DOIs to range 7 structures. | 7052670.cif |
| 35909 | 2012-02-26 | cif/7/: reorganising range 7 into a prefix-directory tree. | 7052670.cif |
| 23721 | 2011-08-09 | ../uploads/cif-deposit/cod/cif Adding structures of 7052668, 7052669, 7052670 via cif-deposit CGI script. |
7052670.cif |
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Users of the data should acknowledge the original authors of the
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