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Information card for entry 4318122
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Coordinates | 4318122.cif |
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Original paper (by DOI) | HTML |
Formula | C20 H25 N O2 Pt S |
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Calculated formula | C20 H25 N O2 Pt S |
SMILES | [Pt]12(c3c(c4[n]2cccc4)scc3)OC(=CC(=[O]1)C(C)(C)C)C(C)(C)C |
Title of publication | Synthesis and Characterization of Phosphorescent Cyclometalated Platinum Complexes |
Authors of publication | Jason Brooks; Yelizaveta Babayan; Sergey Lamansky; Peter I. Djurovich; Irina Tsyba; Robert Bau; Mark E. Thompson |
Journal of publication | Inorganic Chemistry |
Year of publication | 2002 |
Journal volume | 41 |
Pages of publication | 3055 - 3066 |
a | 10.7376 ± 0.0017 Å |
b | 13.804 ± 0.002 Å |
c | 15.995 ± 0.003 Å |
α | 110.487 ± 0.002° |
β | 91.959 ± 0.003° |
γ | 108.925 ± 0.003° |
Cell volume | 2071.4 ± 0.6 Å3 |
Cell temperature | 296 ± 2 K |
Ambient diffraction temperature | 296 ± 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 | 0.0637 |
Residual factor for significantly intense reflections | 0.0455 |
Weighted residual factors for significantly intense reflections | 0.1118 |
Weighted residual factors for all reflections included in the refinement | 0.1215 |
Goodness-of-fit parameter for all reflections included in the refinement | 0.986 |
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/4318122.html
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