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Information card for entry 4326171
Preview
Coordinates | 4326171.cif |
---|---|
Original paper (by DOI) | HTML |
Formula | C30 H20 Cl2 N2 Pd2 S2 |
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Calculated formula | C30 H20 Cl2 N2 Pd2 S2 |
SMILES | [N]1(c2ccccc2)[Pd]2(c3c(C=1)c1c(cccc1)s3)[Cl][Pd]1(c3c(C=[N]1c1ccccc1)c1c(cccc1)s3)[Cl]2 |
Title of publication | Novel Cyclopalladated Imino-thiophenes: Synthesis and Reactivity Toward Alkynes and Carbon Monoxide |
Authors of publication | Luciano Cuesta; Dune Prat; Tatiana Soler; Rafael Navarro; Esteban P. Urriolabeitia |
Journal of publication | Inorganic Chemistry |
Year of publication | 2011 |
Journal volume | 50 |
Pages of publication | 8598 - 8607 |
a | 6.1334 ± 0.0011 Å |
b | 10.3097 ± 0.0018 Å |
c | 11.48 ± 0.002 Å |
α | 108.826 ± 0.004° |
β | 100.35 ± 0.004° |
γ | 101.074 ± 0.004° |
Cell volume | 651.1 ± 0.2 Å3 |
Cell temperature | 173 ± 1 K |
Ambient diffraction temperature | 173 ± 1 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 | 0.0573 |
Residual factor for significantly intense reflections | 0.0409 |
Weighted residual factors for significantly intense reflections | 0.0861 |
Weighted residual factors for all reflections included in the refinement | 0.0911 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.045 |
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/4326171.html
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