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Information card for entry 7000022
Preview
Coordinates | 7000022.cif |
---|---|
Original paper (by DOI) | HTML |
Formula | C12 H17 Cl3 N2 Pd |
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Calculated formula | C12 H17 Cl3 N2 Pd |
SMILES | [Pd]1(Cl)(Cl)[N](=Cc2ccc(Cl)cc2)CCC[N]1(C)C |
Title of publication | Kinetico-mechanistic studies of C-H bond activation on new Pd complexes containing N,N'-chelating ligands. |
Authors of publication | Favier, Isabelle; Gomez, Montserrat; Granell, Jaume; Martinez, Manuel; Solans, Xavier; Font-Bardia, Merce |
Journal of publication | Dalton transactions (Cambridge, England : 2003) |
Year of publication | 2005 |
Journal issue | 1 |
Pages of publication | 123 - 132 |
a | 7.651 ± 0.004 Å |
b | 10.646 ± 0.002 Å |
c | 10.904 ± 0.002 Å |
α | 117.14 ± 0.02° |
β | 100.86 ± 0.02° |
γ | 91.26 ± 0.03° |
Cell volume | 770.3 ± 0.5 Å3 |
Cell temperature | 293 ± 2 K |
Ambient diffraction temperature | 293 ± 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 | 0.106 |
Residual factor for significantly intense reflections | 0.0362 |
Weighted residual factors for significantly intense reflections | 0.0805 |
Weighted residual factors for all reflections included in the refinement | 0.0919 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.011 |
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/7000022.html
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