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Information card for entry 4066927
Preview
| Coordinates | 4066927.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C21 H41 F6 N O2 Os P2 Si |
|---|---|
| Calculated formula | C21 H41 F6 N O2 Os P2 Si |
| SMILES | [Os]123([P](C(C)C)(C(C)C)C(C)C)([NH2]CC=C[C]2(C1)=[C]3([Si](C)(C)C)C)(C#[O])C#[O].[P](F)(F)(F)(F)(F)[F-] |
| Title of publication | Efficient Concatenation of C═C Reduction, C−H Bond Activation, and C−C and C−N Coupling Reactions on Osmium: Assembly of Two Allylamines and an Allene |
| Authors of publication | Baya, Miguel; Esteruelas, Miguel A.; Oñate, Enrique |
| Journal of publication | Organometallics |
| Year of publication | 2010 |
| Journal volume | 29 |
| Journal issue | 23 |
| Pages of publication | 6298 |
| a | 30.456 ± 0.005 Å |
| b | 12.727 ± 0.002 Å |
| c | 14.731 ± 0.003 Å |
| α | 90° |
| β | 90.44 ± 0.002° |
| γ | 90° |
| Cell volume | 5709.8 ± 1.7 Å3 |
| Cell temperature | 100 ± 2 K |
| Ambient diffraction temperature | 100 ± 2 K |
| Number of distinct elements | 8 |
| Space group number | 14 |
| Hermann-Mauguin space group symbol | P 1 21/c 1 |
| Hall space group symbol | -P 2ybc |
| Residual factor for all reflections | 0.0973 |
| Residual factor for significantly intense reflections | 0.0809 |
| Weighted residual factors for significantly intense reflections | 0.2048 |
| Weighted residual factors for all reflections included in the refinement | 0.2213 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.052 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 178561 (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 4/06/69. |
4066927.cif |
| 91935 | 2013-12-29 | cod/ (saulius@koala.ibt.lt) Adding DOIs that could be assigned unambiguously to the rest of COD CIFs. |
4066927.cif |
| 34330 | 2012-02-24 | cif/4/ Reorganising CIF range 4 into a prefix tree. |
4066927.cif |
| 34025 | 2012-02-13 | ../uploads/cif-deposit/cod/cif Adding structures of 4066924, 4066925, 4066926, 4066927 via cif-deposit CGI script. |
4066927.cif |
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