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Information card for entry 2007426
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| Coordinates | 2007426.cif |
|---|---|
| Original IUCr paper | HTML |
| Common name | Doxylamine tetrachlorozincate(II) |
|---|---|
| Formula | C17 H24 Cl4 N2 O Zn |
| Calculated formula | C17 H24 Cl4 N2 O Zn |
| SMILES | [Zn](Cl)(Cl)([Cl-])[Cl-].O(C(c1[nH+]cccc1)(c1ccccc1)C)CC[NH+](C)C |
| Title of publication | Doxylaminium Tetrachlorozincate(II) and Doxylaminium Tetrachlorocobaltate(II) |
| Authors of publication | Parvez, Masood; Sabir, Aaliya P. |
| Journal of publication | Acta Crystallographica Section C |
| Year of publication | 1998 |
| Journal volume | 54 |
| Journal issue | 7 |
| Pages of publication | 933 - 935 |
| a | 9.5604 ± 0.0015 Å |
| b | 18.2218 ± 0.0017 Å |
| c | 12.782 ± 0.003 Å |
| α | 90° |
| β | 107.536 ± 0.017° |
| γ | 90° |
| Cell volume | 2123.2 ± 0.7 Å3 |
| Cell temperature | 293 ± 1 K |
| Ambient diffraction temperature | 293 ± 1 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 | 0.0654 |
| Residual factor for significantly intense reflections | 0.0429 |
| Weighted residual factors for all reflections included in the refinement | 0.1099 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.001 |
| Diffraction radiation wavelength | 1.54178 Å |
| Diffraction radiation type | CuKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
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