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Information card for entry 7223843
Preview
Coordinates | 7223843.cif |
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Original paper (by DOI) | HTML |
Formula | C14 H26 O2 Pd S4 |
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Calculated formula | C14 H26 O2 Pd S4 |
SMILES | [Pd]12([S]=C(OCCCC(C)C)S1)[S]=C(OCCCC(C)C)S2 |
Title of publication | Persistence of C‒H⋯π(chelate ring) interactions in the crystal structures of Pd(S2COR)2. The utility of Pd(S2COR)2as precursors for palladium sulphide materials |
Authors of publication | Tan, Yee Seng; Halim, Siti Nadiah Abdul; Molloy, Kieran C.; Sudlow, Anna L.; Otero-de-la-Roza, A.; Tiekink, Edward R. T. |
Journal of publication | CrystEngComm |
Year of publication | 2016 |
Journal volume | 18 |
Journal issue | 7 |
Pages of publication | 1105 |
a | 7.0663 ± 0.0005 Å |
b | 8.4457 ± 0.0003 Å |
c | 9.2536 ± 0.0004 Å |
α | 63.74 ± 0.004° |
β | 73.752 ± 0.003° |
γ | 83.782 ± 0.003° |
Cell volume | 475.4 ± 0.05 Å3 |
Cell temperature | 100 ± 2 K |
Ambient diffraction temperature | 100 ± 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 | 0.0181 |
Residual factor for significantly intense reflections | 0.0166 |
Weighted residual factors for significantly intense reflections | 0.0418 |
Weighted residual factors for all reflections included in the refinement | 0.0429 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.041 |
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/7223843.html
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