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Information card for entry 4509127
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Coordinates | 4509127.cif |
---|---|
Original paper (by DOI) | HTML |
Common name | PdCl2(ATQACH2NH2) |
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Formula | C10 H18 Cl2 N2 Pd |
Calculated formula | C10 H18 Cl2 N2 Pd |
SMILES | [Pd]1(Cl)(Cl)[N]23C4(CC[C@@H]2CC[C@@H]3CC4)C[NH2]1 |
Title of publication | Crystal Packing in Planar Platinum(II) and Palladium(II) Complexes. Hydrogen-Bond-Mediated Supramolecular Assembly of Ten Wedge-Shaped Molecules into a Cyclic Array |
Authors of publication | Gussenhoven, Emily M.; Jevric, Martyn; Olmstead, Marilyn M.; Fettinger, James C.; Mascal, Mark; Balch, Alan L. |
Journal of publication | Crystal Growth & Design |
Year of publication | 2009 |
Journal volume | 9 |
Journal issue | 4 |
Pages of publication | 1786 |
a | 12.6237 ± 0.0006 Å |
b | 11.0518 ± 0.0005 Å |
c | 8.7066 ± 0.0004 Å |
α | 90° |
β | 100.048 ± 0.001° |
γ | 90° |
Cell volume | 1196.07 ± 0.1 Å3 |
Cell temperature | 90 ± 2 K |
Ambient diffraction temperature | 90 ± 2 K |
Number of distinct elements | 5 |
Space group number | 14 |
Hermann-Mauguin space group symbol | P 1 21/c 1 |
Hall space group symbol | -P 2ybc |
Residual factor for all reflections | 0.0177 |
Residual factor for significantly intense reflections | 0.0148 |
Weighted residual factors for significantly intense reflections | 0.0358 |
Weighted residual factors for all reflections included in the refinement | 0.0371 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.039 |
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/4509127.html
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