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Information card for entry 4065760
Preview
| Coordinates | 4065760.cif |
|---|---|
| Original paper (by DOI) | HTML |
| External links | PubChem |
| Formula | C38 H68 Cl4 Ge3 N2 P4 S4 |
|---|---|
| Calculated formula | C38 H68 Cl4 Ge3 N2 P4 S4 |
| SMILES | [Ge]([Ge](Cl)(Cl)C(P(=S)(C(C)C)C(C)C)c1nc(ccc1)CP(=S)(C(C)C)C(C)C)[Ge](Cl)(Cl)C(P(=S)(C(C)C)C(C)C)c1nc(ccc1)CP(=S)(C(C)C)C(C)C |
| Title of publication | Synthesis of Heavier Group 14 Metal Compounds from 2,6-Lutidylbis(phosphoranosulfide) |
| Authors of publication | Leung, Wing-Por; Kan, Kwok-Wai; Mak, Thomas C. W. |
| Journal of publication | Organometallics |
| Year of publication | 2010 |
| Journal volume | 29 |
| Journal issue | 8 |
| Pages of publication | 1890 |
| a | 9.0484 ± 0.0012 Å |
| b | 13.2864 ± 0.0018 Å |
| c | 22.754 ± 0.003 Å |
| α | 95.876 ± 0.003° |
| β | 92.024 ± 0.003° |
| γ | 93.584 ± 0.003° |
| Cell volume | 2713.4 ± 0.6 Å3 |
| Cell temperature | 293 ± 2 K |
| Ambient diffraction temperature | 293 ± 2 K |
| Number of distinct elements | 7 |
| Space group number | 2 |
| Hermann-Mauguin space group symbol | P -1 |
| Hall space group symbol | -P 1 |
| Residual factor for all reflections | 0.0866 |
| Residual factor for significantly intense reflections | 0.046 |
| Weighted residual factors for significantly intense reflections | 0.1062 |
| Weighted residual factors for all reflections included in the refinement | 0.128 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.023 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 301829 (current) | 2025-08-20 | Add cross-references to PubChem compounds in COD range 4/06/ Each referenced PubChem compound corresponds to the full crystal structure. |
4065760.cif |
| 178550 | 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 4/06/57. |
4065760.cif |
| 91935 | 2013-12-29 | cod/ (saulius@koala.ibt.lt) Adding DOIs that could be assigned unambiguously to the rest of COD CIFs. |
4065760.cif |
| 34330 | 2012-02-24 | cif/4/ Reorganising CIF range 4 into a prefix tree. |
4065760.cif |
| 33680 | 2012-02-13 | ../uploads/cif-deposit/cod/cif Adding structures of 4065758, 4065759, 4065760, 4065761, 4065762 via cif-deposit CGI script. |
4065760.cif |
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Users of the data should acknowledge the original authors of the
structural data.