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Information card for entry 4327621
Preview
| Coordinates | 4327621.cif |
|---|---|
| Original paper (by DOI) | HTML |
| External links | PubChem |
| Formula | C42.5 H68 Li2 N5 Si2 |
|---|---|
| Calculated formula | C42.5 H68 Li2 N5 Si2 |
| Title of publication | Synthesis and Structural Characterization of Metalated 1,8-Bis(silylamino)naphthalene Derivatives |
| Authors of publication | Christian H. Galka; Dominique J. M. Trösch; Ina Rüdenauer; Lutz H. Gade; Ian Scowen; Mary McPartlin |
| Journal of publication | Inorganic Chemistry |
| Year of publication | 2000 |
| Journal volume | 39 |
| Pages of publication | 4615 - 4620 |
| a | 11.645 ± 0.003 Å |
| b | 12.173 ± 0.003 Å |
| c | 15.959 ± 0.004 Å |
| α | 97.03 ± 0.014° |
| β | 95.118 ± 0.014° |
| γ | 90.331 ± 0.015° |
| Cell volume | 2236 ± 1 Å3 |
| Cell temperature | 173 ± 2 K |
| Ambient diffraction temperature | 173 ± 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 | 0.1006 |
| Residual factor for significantly intense reflections | 0.0709 |
| Weighted residual factors for significantly intense reflections | 0.1878 |
| Weighted residual factors for all reflections included in the refinement | 0.2114 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.076 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | Yes |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 301838 (current) | 2025-08-21 | Add cross-references to PubChem compounds in COD range 4/32/ Each referenced PubChem compound corresponds to the full crystal structure. |
4327621.cif |
| 176467 | 2016-02-16 | cif/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in range 4. |
4327621.cif |
| 120105 | 2014-07-12 | Adding DOIs to range 4/32 structures. | 4327621.cif |
| 61453 | 2012-07-04 | cif/ Adding structures of 4327621 via cif-deposit CGI script. |
4327621.cif |
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Users of the data should acknowledge the original authors of the
structural data.