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Information card for entry 7005128
Preview
Coordinates | 7005128.cif |
---|---|
Original paper (by DOI) | HTML |
Formula | C19 H21 Cl N O3 P Pd |
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Calculated formula | C19 H21 Cl N O3 P Pd |
SMILES | [Pd]1(Cl)([P]2(OCC3OCC([N]1=3)(C)C)Oc1ccccc1c1ccccc21)C |
Title of publication | Phosphinito- and phosphonito-oxazoline Pd(II) complexes as CO/ethylene insertion intermediates: synthesis and structural characterization. |
Authors of publication | Agostinho, Magno; Braunstein, Pierre; Welter, Richard |
Journal of publication | Dalton transactions (Cambridge, England : 2003) |
Year of publication | 2007 |
Journal issue | 7 |
Pages of publication | 759 - 770 |
a | 10.799 ± 0.0001 Å |
b | 16.216 ± 0.0002 Å |
c | 21.679 ± 0.0003 Å |
α | 90° |
β | 90° |
γ | 90° |
Cell volume | 3796.35 ± 0.08 Å3 |
Cell temperature | 173 ± 2 K |
Ambient diffraction temperature | 173 ± 2 K |
Number of distinct elements | 7 |
Space group number | 61 |
Hermann-Mauguin space group symbol | P b c a |
Hall space group symbol | -P 2ac 2ab |
Residual factor for all reflections | 0.0618 |
Residual factor for significantly intense reflections | 0.03 |
Weighted residual factors for significantly intense reflections | 0.0903 |
Weighted residual factors for all reflections included in the refinement | 0.0978 |
Goodness-of-fit parameter for all reflections included in the refinement | 0.767 |
Diffraction radiation wavelength | 0.71069 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/7005128.html
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