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Information card for entry 4085615
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Coordinates | 4085615.cif |
---|---|
Original paper (by DOI) | HTML |
Chemical name | trans-(dmso)2Pt(Mes)2 |
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Formula | C22 H34 O2 Pt S2 |
Calculated formula | C22 H34 O2 Pt S2 |
SMILES | Cc1c([Pt]([S](=O)(C)C)([S](=O)(C)C)c2c(cc(cc2C)C)C)c(cc(c1)C)C |
Title of publication | Multiple Isomerism (cis/trans; syn/anti) in [(dmso)~2~Pt(aryl)~2~] Complexes: A Combined Structural, Spectroscopic, and Theoretical Investigation |
Authors of publication | Klein, Axel; Schurr, Thilo; Knödler, Axel; Gudat, Dietrich; Klinkhammer, Karl-Wilhelm; Jain, Vimal K.; Záliš, Stanislav; Kaim, Wolfgang |
Journal of publication | Organometallics |
Year of publication | 2005 |
Journal volume | 24 |
Journal issue | 17 |
Pages of publication | 4125 - 4131 |
a | 7.85 ± 0.0016 Å |
b | 9.262 ± 0.0019 Å |
c | 16.002 ± 0.003 Å |
α | 90° |
β | 95.66 ± 0.03° |
γ | 90° |
Cell volume | 1157.8 ± 0.4 Å3 |
Cell temperature | 293 ± 2 K |
Ambient diffraction temperature | 293 ± 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 | 0.0772 |
Residual factor for significantly intense reflections | 0.0707 |
Weighted residual factors for significantly intense reflections | 0.1367 |
Weighted residual factors for all reflections included in the refinement | 0.1374 |
Goodness-of-fit parameter for all reflections included in the refinement | 3.072 |
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/4085615.html
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Users of the data should acknowledge the original authors of the
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