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Information card for entry 2233399
Preview
Coordinates | 2233399.cif |
---|---|
Structure factors | 2233399.hkl |
Original IUCr paper | HTML |
Chemical name | {2-[Bis(2,4-di-<i>tert</i>-butylphenoxy)phosphanyloxy-κ<i>P</i>]-3,5-di- <i>tert</i>-butylphenyl-κ<i>C</i>^1^}[(1,2,5,6-η)-cycloocta-1,5- diene]rhodium(I) toluene monosolvate |
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Formula | C57 H82 O3 P Rh |
Calculated formula | C57 H82 O3 P Rh |
Title of publication | {2-[Bis(2,4-di-<i>tert</i>-butylphenoxy)phosphanyloxy-κ<i>P</i>]-3,5-di-<i>tert</i>-butylphenyl-κ<i>C</i>^1^}[(1,2,5,6-η)-cycloocta-1,5-diene]rhodium(I) toluene monosolvate |
Authors of publication | Selent, Detlef; Spannenberg, Anke; Börner, Armin |
Journal of publication | Acta Crystallographica Section E |
Year of publication | 2012 |
Journal volume | 68 |
Journal issue | 2 |
Pages of publication | m215 |
a | 11.1212 ± 0.0003 Å |
b | 12.5865 ± 0.0003 Å |
c | 20.069 ± 0.0005 Å |
α | 106.891 ± 0.001° |
β | 102.344 ± 0.001° |
γ | 94.483 ± 0.001° |
Cell volume | 2596.13 ± 0.12 Å3 |
Cell temperature | 150 ± 2 K |
Ambient diffraction temperature | 150 ± 2 K |
Number of distinct elements | 5 |
Space group number | 2 |
Hermann-Mauguin space group symbol | P -1 |
Hall space group symbol | -P 1 |
Residual factor for all reflections | 0.0294 |
Residual factor for significantly intense reflections | 0.0265 |
Weighted residual factors for significantly intense reflections | 0.0666 |
Weighted residual factors for all reflections included in the refinement | 0.0691 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.021 |
Diffraction radiation wavelength | 0.71073 Å |
Diffraction radiation type | MoKα |
Has coordinates | Yes |
Has disorder | Yes |
Has Fobs | Yes |
For the version history of this entry, please navigate to main COD server.
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