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Information card for entry 2229887
Preview
Coordinates | 2229887.cif |
---|---|
Structure factors | 2229887.hkl |
Original IUCr paper | HTML |
Chemical name | [1,2-Bis(diphenylphosphanyl)ethane-κ^2^<i>P</i>,<i>P</i>']{2-[(4- nitrobenzoylmethyl)diphenylphosphanyl]phenyl- κ^2^<i>C</i>,<i>C</i>'}palladium(II) trifluoromethanesulfonate‒dichloromethane‒<i>n</i>-hexane (1/1/0.5) |
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Formula | C57 H52 Cl2 F3 N O6 P3 Pd S |
Calculated formula | C57 H52 Cl2 F3 N O6 P3 Pd S |
Title of publication | [1,2-Bis(diphenylphosphanyl)ethane-κ^2^<i>P</i>,<i>P</i>']{2-[(4-nitrobenzoylmethyl)diphenylphosphanyl]phenyl-κ^2^<i>C</i>,<i>C</i>'}palladium(II) trifluoromethanesulfonate‒dichloromethane‒<i>n</i>-hexane (1/1/0.5) |
Authors of publication | Rizzoli, Corrado; Karami, Kazem; Borzooie, Farzaneh |
Journal of publication | Acta Crystallographica Section E |
Year of publication | 2011 |
Journal volume | 67 |
Journal issue | 4 |
Pages of publication | m416 - m417 |
a | 12.4063 ± 0.0007 Å |
b | 14.2445 ± 0.0008 Å |
c | 31.3633 ± 0.0017 Å |
α | 90° |
β | 91.6675 ± 0.0009° |
γ | 90° |
Cell volume | 5540.2 ± 0.5 Å3 |
Cell temperature | 294 ± 2 K |
Ambient diffraction temperature | 294 ± 2 K |
Number of distinct elements | 9 |
Space group number | 14 |
Hermann-Mauguin space group symbol | P 1 21/n 1 |
Hall space group symbol | -P 2yn |
Residual factor for all reflections | 0.0441 |
Residual factor for significantly intense reflections | 0.0291 |
Weighted residual factors for significantly intense reflections | 0.0717 |
Weighted residual factors for all reflections included in the refinement | 0.0761 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.036 |
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.
The link is: https://www.crystallography.net/2229887.html
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