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Information card for entry 4067502
Preview
| Coordinates | 4067502.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C66 H84 Al2 N2 O2 P4 S2 Si2 |
|---|---|
| Calculated formula | C66 H84 Al2 N2 O2 P4 S2 Si2 |
| SMILES | C[Al]12C(=P(c3ccccc3)(c3ccccc3)N1[Si](C)(C)C)P(=[S][Al]1(C)C(=P(c3ccccc3)(c3ccccc3)N1[Si](C)(C)C)P(=[S]2)(c1ccccc1)c1ccccc1)(c1ccccc1)c1ccccc1.O(CC)CC.O(CC)CC |
| Title of publication | Synthesis and Characterization of Magnesium and Aluminum Bis(phosphoranyl)methanediide Complexes |
| Authors of publication | Guo, Jiayi; Lee, Jia-Shin; Foo, Ming-Choo; Lau, Kai-Chung; Xi, Hong-Wei; Lim, Kok Hwa; So, Cheuk-Wai |
| Journal of publication | Organometallics |
| Year of publication | 2010 |
| Journal volume | 29 |
| Journal issue | 4 |
| Pages of publication | 939 |
| a | 10.9906 ± 0.0001 Å |
| b | 20.9657 ± 0.0003 Å |
| c | 15.584 ± 0.0002 Å |
| α | 90° |
| β | 108.78 ± 0.001° |
| γ | 90° |
| Cell volume | 3399.78 ± 0.08 Å3 |
| Cell temperature | 103 ± 2 K |
| Ambient diffraction temperature | 103 ± 2 K |
| Number of distinct elements | 8 |
| 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 | 0.0702 |
| Residual factor for significantly intense reflections | 0.0415 |
| Weighted residual factors for significantly intense reflections | 0.1113 |
| Weighted residual factors for all reflections included in the refinement | 0.1373 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.12 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 178566 (current) | 2016-03-21 | cif/4/06/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 4/06/75. |
4067502.cif |
| 91935 | 2013-12-29 | cod/ (saulius@koala.ibt.lt) Adding DOIs that could be assigned unambiguously to the rest of COD CIFs. |
4067502.cif |
| 34330 | 2012-02-24 | cif/4/ Reorganising CIF range 4 into a prefix tree. |
4067502.cif |
| 34215 | 2012-02-13 | ../uploads/cif-deposit/cod/cif Adding structures of 4067499, 4067500, 4067501, 4067502 via cif-deposit CGI script. |
4067502.cif |
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