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Information card for entry 7062971
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Coordinates | 7062971.cif |
---|---|
Original paper (by DOI) | HTML |
Chemical name | bis(μ2-2-(bis(2-Pyridylmethyl)amino)ethanethiolato-N,N',N",S)-di-cadmium(ii) chloride m-xylene solvate |
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Formula | C36 H42 Cd2 Cl2 N6 S2 |
Calculated formula | C36 H42 Cd2 Cl2 N6 S2 |
Title of publication | Aggregation behavior of group 12 complexes of a tripodal mixed NS(thiolato) donor ligand |
Authors of publication | Sturner, Michelle A.; Thomas, Isla D.; Owusu-Koramoah, Joshua E.; Reynolds, Todd M.; Berry, Steven M.; Butcher, Raymond J.; Bebout, Deborah C. |
Journal of publication | New Journal of Chemistry |
Year of publication | 2024 |
Journal volume | 48 |
Journal issue | 6 |
Pages of publication | 2547 - 2557 |
a | 9.5643 ± 0.0006 Å |
b | 9.6576 ± 0.0006 Å |
c | 11.126 ± 0.0007 Å |
α | 104.832 ± 0.002° |
β | 105.857 ± 0.002° |
γ | 91.085 ± 0.002° |
Cell volume | 951.27 ± 0.1 Å3 |
Cell temperature | 133 ± 2 K |
Ambient diffraction temperature | 133 ± 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 | 0.0144 |
Residual factor for significantly intense reflections | 0.014 |
Weighted residual factors for significantly intense reflections | 0.0363 |
Weighted residual factors for all reflections included in the refinement | 0.0365 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.054 |
Diffraction radiation wavelength | 0.71073 Å |
Diffraction radiation type | MoKα |
Has coordinates | Yes |
Has disorder | Yes |
Has Fobs | No |
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