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Information card for entry 4069155
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Coordinates | 4069155.cif |
---|---|
Original paper (by DOI) | HTML |
Chemical name | Dicarbonyl(triphenylphosphite)[(eta-6-1,2,3,4,4a,1a)-1-tert-butyldimethyl- siloxy-2,3-diethyl-4-methoxyphenanthrene]chromium |
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Formula | C45 H49 Cr O7 P Si |
Calculated formula | C45 H49 Cr O7 P Si |
SMILES | [Cr]12345(C#[O])(C#[O])([P](Oc6ccccc6)(Oc6ccccc6)Oc6ccccc6)[c]6(OC)[c]1(CC)[c]2([c]3(O[Si](C)(C)C(C)(C)C)[c]14[c]56c2c(cc1)cccc2)CC |
Title of publication | P-Coligand Tuning of the Haptotropic Metal Migration in Phenanthrene Chromium Complexes |
Authors of publication | Joistgen, Oliver; Pfletschinger, Anja; Ciupka, Jan; Dolg, Michael; Nieger, Martin; Schnakenburg, Gregor; Fröhlich, Roland; Kataeva, Olga; Dötz, Karl Heinz |
Journal of publication | Organometallics |
Year of publication | 2009 |
Journal volume | 28 |
Journal issue | 12 |
Pages of publication | 3473 |
a | 9.308 ± 0.0001 Å |
b | 11.1984 ± 0.0002 Å |
c | 21.5305 ± 0.0005 Å |
α | 80.901 ± 0.001° |
β | 84.642 ± 0.001° |
γ | 65.482 ± 0.001° |
Cell volume | 2015.21 ± 0.07 Å3 |
Cell temperature | 123 ± 2 K |
Ambient diffraction temperature | 123 ± 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 | 0.0542 |
Residual factor for significantly intense reflections | 0.0339 |
Weighted residual factors for significantly intense reflections | 0.0789 |
Weighted residual factors for all reflections included in the refinement | 0.0845 |
Goodness-of-fit parameter for all reflections included in the refinement | 0.994 |
Diffraction radiation wavelength | 0.71073 Å |
Diffraction radiation type | MoKα |
Has coordinates | Yes |
Has disorder | No |
Has Fobs | No |
For the version history of this entry, please navigate to main COD server.
The link is: https://www.crystallography.net/4069155.html
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Users of the data should acknowledge the original authors of the
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