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Information card for entry 4318552
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Jmol._Canvas2D (Jmol) "jmolApplet0"[x]
Coordinates | 4318552.cif |
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Original paper (by DOI) | HTML |
Formula | C12 H10 Cl2 N2 O4 Pd |
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Calculated formula | C12 H10 Cl2 N2 O4 Pd |
SMILES | c1cc(C(=O)O)cc[n]1[Pd]([n]1ccc(C(=O)O)cc1)(Cl)Cl |
Title of publication | Self-Assembly of Polymer and Sheet Structures in Palladium(II) Complexes Containing Carboxylic Acid Substituents |
Authors of publication | Zengquan Qin; Michael C. Jennings; Richard J. Puddephatt; Kenneth W. Muir |
Journal of publication | Inorganic Chemistry |
Year of publication | 2002 |
Journal volume | 41 |
Pages of publication | 5174 - 5186 |
a | 3.9554 ± 0.0002 Å |
b | 7.483 ± 0.0004 Å |
c | 12.5456 ± 0.0007 Å |
α | 75.625 ± 0.003° |
β | 88.898 ± 0.003° |
γ | 80.313 ± 0.003° |
Cell volume | 354.47 ± 0.03 Å3 |
Cell temperature | 295 ± 2 K |
Ambient diffraction temperature | 295 ± 2 K |
Number of distinct elements | 6 |
Space group number | 2 |
Hermann-Mauguin space group symbol | P -1 |
Hall space group symbol | -P 1 |
Residual factor for all reflections | 0.0271 |
Residual factor for significantly intense reflections | 0.0238 |
Weighted residual factors for all reflections | 0.0607 |
Weighted residual factors for significantly intense reflections | 0.0582 |
Goodness-of-fit parameter for all reflections | 1.021 |
Goodness-of-fit parameter for significantly intense reflections | 1.009 |
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/4318552.html
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Users of the data should acknowledge the original authors of the
structural data.