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Information card for entry 2241430
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| Coordinates | 2241430.cif |
|---|---|
| Structure factors | 2241430.hkl |
| Original paper (by DOI) | HTML |
| Chemical name | Tri-<i>tert</i>-butylphosphonium aquatrichloridozincate 1,2-dichloroethane monosolvate |
|---|---|
| Formula | C14 H34 Cl5 O P Zn |
| Calculated formula | C14 H34 Cl5 O P Zn |
| Title of publication | Crystal structures of three complexes of zinc chloride with tri-<i>tert</i>-butylphosphane |
| Authors of publication | Finke, Aaron D.; Gray, Danielle L.; Moore, Jeffrey S. |
| Journal of publication | Acta Crystallographica Section E |
| Year of publication | 2016 |
| Journal volume | 72 |
| Journal issue | 1 |
| Pages of publication | 35 - 39 |
| a | 25.3722 ± 0.0005 Å |
| b | 8.5841 ± 0.0002 Å |
| c | 32.912 ± 0.002 Å |
| α | 90° |
| β | 98.909 ± 0.007° |
| γ | 90° |
| Cell volume | 7081.7 ± 0.5 Å3 |
| Cell temperature | 123 ± 2 K |
| Ambient diffraction temperature | 123.15 K |
| Number of distinct elements | 6 |
| Space group number | 14 |
| Hermann-Mauguin space group symbol | P 1 21/n 1 |
| Hall space group symbol | -P 2yn |
| Residual factor for all reflections | 0.0812 |
| Residual factor for significantly intense reflections | 0.0487 |
| Weighted residual factors for significantly intense reflections | 0.1241 |
| Weighted residual factors for all reflections included in the refinement | 0.1417 |
| Goodness-of-fit parameter for all reflections included in the refinement | 0.982 |
| Diffraction radiation wavelength | 1.54187 Å |
| Diffraction radiation type | CuKα |
| Has coordinates | Yes |
| Has disorder | Yes |
| Has Fobs | Yes |
| Revision | Date | Message | Files |
|---|---|---|---|
| 181915 (current) | 2016-04-06 | hkl/2/24/ (antanas@echidna) Adding IUCr specific svn headers to multiple entries in subrange 2/24/14. |
2241430.cif 2241430.hkl |
| 176638 | 2016-02-17 | cif/ Updating files of 2241428, 2241429, 2241430 Original log message: Adding full bibliography for 2241428--2241430.cif. |
2241430.cif 2241430.hkl |
| 176585 | 2016-02-17 | cif/ Updating files of 2241428, 2241429, 2241430 Original log message: Adding full bibliography for 2241428--2241430.cif. |
2241430.cif 2241430.hkl |
| 171641 | 2015-12-20 | cif/ hkl/ Adding structures of 2241428, 2241429, 2241430 via cif-deposit CGI script. |
2241430.cif 2241430.hkl |
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