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Information card for entry 7007854
Preview
Coordinates | 7007854.cif |
---|---|
Original paper (by DOI) | HTML |
Chemical name | (2,6-Diisopropyl-phenyl)-(1-diphenylphosphanyl-1H-pyrrol-2- ylmethylene)-amine palladium dichloride |
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Formula | C29 H31 Cl2 N2 P Pd |
Calculated formula | C29 H31 Cl2 N2 P Pd |
SMILES | [Pd]1(Cl)(Cl)[P](n2c(C=[N]1c1c(cccc1C(C)C)C(C)C)ccc2)(c1ccccc1)c1ccccc1 |
Title of publication | Chelating N-pyrrolylphosphino-N'-arylaldimine ligands: synthesis, ligand behaviour and applications in catalysis. |
Authors of publication | Anderson, Carly E.; Batsanov, Andrei S.; Dyer, Philip W.; Fawcett, John; Howard, Judith A. K. |
Journal of publication | Dalton transactions (Cambridge, England : 2003) |
Year of publication | 2006 |
Journal issue | 45 |
Pages of publication | 5362 - 5378 |
a | 32.505 ± 0.004 Å |
b | 9.9996 ± 0.0011 Å |
c | 17.8876 ± 0.0019 Å |
α | 90° |
β | 102.609 ± 0.002° |
γ | 90° |
Cell volume | 5673.9 ± 1.1 Å3 |
Cell temperature | 150 ± 2 K |
Ambient diffraction temperature | 150 ± 2 K |
Number of distinct elements | 6 |
Space group number | 15 |
Hermann-Mauguin space group symbol | C 1 2/c 1 |
Hall space group symbol | -C 2yc |
Residual factor for all reflections | 0.0274 |
Residual factor for significantly intense reflections | 0.0251 |
Weighted residual factors for significantly intense reflections | 0.0648 |
Weighted residual factors for all reflections included in the refinement | 0.066 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.07 |
Diffraction radiation wavelength | 0.71073 Å |
Diffraction radiation type | MoKα |
Has coordinates | Yes |
Has disorder | No |
Has Fobs | No |
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The link is: https://www.crystallography.net/7007854.html
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