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Information card for entry 4067360
Preview
| Coordinates | 4067360.cif |
|---|---|
| Original paper (by DOI) | HTML |
| External links | PubChem |
| Formula | C66 H74 Cl2 Ge2 O4 P4 S6 |
|---|---|
| Calculated formula | C66 H74 Cl2 Ge2 O4 P4 S6 |
| SMILES | C(P(=S)(c1ccccc1)c1ccccc1)(P(=S)(c1ccccc1)c1ccccc1)[Ge]1(S[Ge](C(P(=S)(c2ccccc2)c2ccccc2)P(=S)(c2ccccc2)c2ccccc2)(S1)Cl)Cl.O1CCCC1.O1CCCC1.O1CCCC1.O1CCCC1 |
| Title of publication | Synthesis, Structure, and Reactivity of Group 14 Bis(thiophosphinoyl) Metal Complexes |
| Authors of publication | Leung, Wing-Por; Wan, Chi-Ling; Kan, Kwok-Wai; Mak, Thomas C. W. |
| Journal of publication | Organometallics |
| Year of publication | 2010 |
| Journal volume | 29 |
| Journal issue | 4 |
| Pages of publication | 814 |
| a | 19.263 ± 0.003 Å |
| b | 13.8672 ± 0.0019 Å |
| c | 28.132 ± 0.004 Å |
| α | 90° |
| β | 93.501 ± 0.003° |
| γ | 90° |
| Cell volume | 7500.7 ± 1.9 Å3 |
| Cell temperature | 293 ± 2 K |
| Ambient diffraction temperature | 293 ± 2 K |
| Number of distinct elements | 7 |
| Space group number | 15 |
| Hermann-Mauguin space group symbol | C 1 2/c 1 |
| Hall space group symbol | -C 2yc |
| Residual factor for all reflections | 0.141 |
| Residual factor for significantly intense reflections | 0.0573 |
| Weighted residual factors for significantly intense reflections | 0.1366 |
| Weighted residual factors for all reflections included in the refinement | 0.1598 |
| Goodness-of-fit parameter for all reflections included in the refinement | 0.829 |
| 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. |
4067360.cif |
| 178564 | 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 4/06/73. |
4067360.cif |
| 91935 | 2013-12-29 | cod/ (saulius@koala.ibt.lt) Adding DOIs that could be assigned unambiguously to the rest of COD CIFs. |
4067360.cif |
| 34330 | 2012-02-24 | cif/4/ Reorganising CIF range 4 into a prefix tree. |
4067360.cif |
| 34174 | 2012-02-13 | ../uploads/cif-deposit/cod/cif Adding structures of 4067360 via cif-deposit CGI script. |
4067360.cif |
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