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Information card for entry 4071082
Preview
| Coordinates | 4071082.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Chemical name | {[1,3-bis(2,4,6-trimethylphenyl)-2-imidazolinylidene]dichloro- {[(2-isopropoxyphenyl)methylene]tricarbonylchromium}}ruthenium |
|---|---|
| Formula | C34 H27 Cl2 Cr N2 O4 Ru |
| Calculated formula | C34 H27 Cl2 Cr N2 O4 Ru |
| Title of publication | A New, Highly Active Bimetallic Grubbs‒Hoveyda‒Blechert Precatalyst for Alkene Metathesis |
| Authors of publication | Vinokurov, Nikolai; Garabatos-Perera, José Ramon; Zhao-Karger, Zhirong; Wiebcke, Michael; Butenschön, Holger |
| Journal of publication | Organometallics |
| Year of publication | 2008 |
| Journal volume | 27 |
| Journal issue | 8 |
| Pages of publication | 1878 |
| a | 9.996 ± 0.004 Å |
| b | 23.873 ± 0.008 Å |
| c | 15.218 ± 0.006 Å |
| α | 90° |
| β | 99.64 ± 0.05° |
| γ | 90° |
| Cell volume | 3580 ± 2 Å3 |
| Cell temperature | 298 K |
| Ambient diffraction temperature | 298 K |
| Number of distinct elements | 7 |
| 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 | 0.1383 |
| Residual factor for significantly intense reflections | 0.0442 |
| Weighted residual factors for significantly intense reflections | 0.0615 |
| Weighted residual factors for all reflections included in the refinement | 0.0723 |
| Goodness-of-fit parameter for all reflections included in the refinement | 0.699 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 176467 (current) | 2016-02-16 | cif/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in range 4. |
4071082.cif |
| 120075 | 2014-07-11 | Adding DOIs to range 4/07 structures. | 4071082.cif |
| 47256 | 2012-03-23 | cif/4/ Distributing the new range 4 CIFs into their appropriate prefixed subdirectories. |
4071082.cif |
| 43033 | 2012-03-13 | ../uploads/cif-deposit/cod/cif Adding structures of 4071082 via cif-deposit CGI script. |
4071082.cif |
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Users of the data should acknowledge the original authors of the
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