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Information card for entry 4068950
Preview
| Coordinates | 4068950.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C32 H62 N2 P2 Si4 Sn |
|---|---|
| Calculated formula | C32 H62 N2 P2 Si4 Sn |
| SMILES | [Sn]1(P(C([Si](C)(C)C)[Si](C)(C)C)c2ccccc2C[N]1(C)C)P(C([Si](C)(C)C)[Si](C)(C)C)c1ccccc1CN(C)C |
| Title of publication | Dynamic Behavior of Intramolecularly Base-Stabilized Phosphatetrylenes. Insights into the Inversion Processes of Trigonal Pyramidal Geramanium(II) and Tin(II) Centers |
| Authors of publication | Izod, Keith; Stewart, John; Clark, Ewan R.; McFarlane, William; Allen, Ben; Clegg, William; Harrington, Ross W. |
| Journal of publication | Organometallics |
| Year of publication | 2009 |
| Journal volume | 28 |
| Journal issue | 12 |
| Pages of publication | 3327 |
| a | 12.7543 ± 0.0006 Å |
| b | 12.8444 ± 0.0006 Å |
| c | 25.4612 ± 0.0012 Å |
| α | 90.789 ± 0.002° |
| β | 90.187 ± 0.002° |
| γ | 101.872 ± 0.002° |
| Cell volume | 4081.4 ± 0.3 Å3 |
| Cell temperature | 160 ± 2 K |
| Ambient diffraction temperature | 160 ± 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 | 0.0635 |
| Residual factor for significantly intense reflections | 0.0453 |
| Weighted residual factors for significantly intense reflections | 0.104 |
| Weighted residual factors for all reflections included in the refinement | 0.1108 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.049 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 178579 (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 4/06/89. |
4068950.cif |
| 91935 | 2013-12-29 | cod/ (saulius@koala.ibt.lt) Adding DOIs that could be assigned unambiguously to the rest of COD CIFs. |
4068950.cif |
| 40055 | 2012-03-07 | ../uploads/cif-deposit/cod/cif Adding structures of 4068949, 4068950 via cif-deposit CGI script. |
4068950.cif |
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Users of the data should acknowledge the original authors of the
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