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Information card for entry 7111575
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| Coordinates | 7111575.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Common name | (mu!2$-di-t-butylstanna)-tetracarbonyl-bis(eta$5!- cyclopentadienyl)-di-iron |
|---|---|
| Chemical name | (μ~2~-di-t-butylstanna)-tetracarbonyl-bis(η^5^-cyclopentadienyl)-di-iron |
| Formula | C22 H28 Fe2 O4 Sn |
| Calculated formula | C22 H28 Fe2 O4 Sn |
| SMILES | C(C)(C)([Sn](C(C)(C)C)([Fe]1234([cH]5[cH]1[cH]2[cH]3[cH]45)(C#[O])C#[O])[Fe]1234([cH]5[cH]1[cH]2[cH]3[cH]45)(C#[O])C#[O])C |
| Title of publication | Methyl transfer from Fe (and Mo) to Sn: formation of (η5-C5H5)M(CO)nSntBu2Me (M = Fe, n = 2; M = Mo, n = 3) complexes from photochemical irradiation of (η5-C5H5)M(CO)nMe and tBu2SnH2 |
| Authors of publication | Sharma, Hemant K.; Arias-Ugarte, Renzo; Metta-Magana, Alejandro; Pannell, Keith H. |
| Journal of publication | Chemical Communications |
| Year of publication | 2010 |
| Journal volume | 46 |
| Journal issue | 25 |
| Pages of publication | 4586 - 4588 |
| a | 17.479 ± 0.005 Å |
| b | 9.024 ± 0.002 Å |
| c | 16.126 ± 0.004 Å |
| α | 90° |
| β | 113.611 ± 0.006° |
| γ | 90° |
| Cell volume | 2330.6 ± 1 Å3 |
| Cell temperature | 298 ± 2 K |
| Ambient diffraction temperature | 298 ± 2 K |
| Number of distinct elements | 5 |
| 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 | 0.0563 |
| Residual factor for significantly intense reflections | 0.0369 |
| Weighted residual factors for significantly intense reflections | 0.0756 |
| Weighted residual factors for all reflections included in the refinement | 0.0833 |
| Goodness-of-fit parameter for all reflections included in the refinement | 0.99 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 180229 (current) | 2016-03-26 | cif/7/11/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 7/11/15. |
7111575.cif |
| 96672 | 2014-01-29 | cif/ Adding structures of 7111575, 7111576 via cif-deposit CGI script. |
7111575.cif |
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