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Information card for entry 4075704
Preview
| Coordinates | 4075704.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C40 H88 Ge2 K2 O12 Si4 |
|---|---|
| Calculated formula | C40 H88 Ge2 K2 O12 Si4 |
| SMILES | [K]12345[O]6CC[O]1CC[O]2CC[O]3CC[O]4CC[O]5CC6.[K]12345[O]6CC[O]1CC[O]2CC[O]3CC[O]4CC[O]5CC6.[Ge-]([Ge-]([Si](C)(C)C)[Si](C)(C)C)([Si](C)(C)C)[Si](C)(C)C.c1ccccc1 |
| Title of publication | Silylgermylpotassium Compounds |
| Authors of publication | Fischer, Jelena; Baumgartner, Judith; Marschner, Christoph |
| Journal of publication | Organometallics |
| Year of publication | 2005 |
| Journal volume | 24 |
| Journal issue | 6 |
| Pages of publication | 1263 |
| a | 11.906 ± 0.002 Å |
| b | 19.793 ± 0.004 Å |
| c | 20.304 ± 0.004 Å |
| α | 114.5 ± 0.03° |
| β | 91.99 ± 0.03° |
| γ | 102.03 ± 0.03° |
| Cell volume | 4218.7 ± 1.9 Å3 |
| Cell temperature | 100 ± 2 K |
| Ambient diffraction temperature | 100 ± 2 K |
| Number of distinct elements | 6 |
| Space group number | 2 |
| Hermann-Mauguin space group symbol | P -1 |
| Hall space group symbol | -P 1 |
| Residual factor for all reflections | 0.0707 |
| Residual factor for significantly intense reflections | 0.0522 |
| Weighted residual factors for significantly intense reflections | 0.1399 |
| Weighted residual factors for all reflections included in the refinement | 0.1506 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.031 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 301830 (current) | 2025-08-20 | Add cross-references to PubChem compounds in COD range 4/07/ Each referenced PubChem compound corresponds to the full crystal structure. |
4075704.cif |
| 187017 | 2016-10-07 | Fixing some Z values and formulae in K compounds. |
4075704.cif |
| 178646 | 2016-03-21 | cif/4/07/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 4/07/57. |
4075704.cif |
| 120075 | 2014-07-11 | Adding DOIs to range 4/07 structures. | 4075704.cif |
| 50631 | 2012-03-31 | ../uploads/cif-deposit/cod/cif Adding structures of 4075703, 4075704, 4075705 via cif-deposit CGI script. |
4075704.cif |
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Users of the data should acknowledge the original authors of the
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